U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C17H21NO
Molecular Weight 255.3547
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOFENACIN

SMILES

CNCCOC(C1=CC=CC=C1)C2=C(C)C=CC=C2

InChI

InChIKey=PNYKGCPSFKLFKA-UHFFFAOYSA-N
InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)17(19-13-12-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C17H21NO
Molecular Weight 255.3547
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

1-[3-(Benzyloxy)phenyl]-N,N-dimethylethanamine is an intermediate compound in the chemical synthesis of a drug Rivastigmine, which is used to treat Alzheimer's and Parkinson's disease.

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Thu Jul 06 01:41:12 UTC 2023
Edited
by admin
on Thu Jul 06 01:41:12 UTC 2023
Record UNII
C4A112M10H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TOFENACIN
INN   MI   WHO-DD  
INN  
Official Name English
TOFENACIN [MI]
Common Name English
ETHANAMINE, N-METHYL-2-((2-METHYLPHENYL)PHENYLMETHOXY)-
Systematic Name English
J8.547B
Code English
NORORPHENADRINE
Common Name English
tofenacin [INN]
Common Name English
N-METHYL-2-((O-METHYL-.ALPHA.-PHENYLBENZYL)OXY)ETHYLAMINE
Common Name English
DEMETHYLORPHENADRINE
Common Name English
TOFENACINE
Common Name English
Tofenacin [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
239-338-0
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
MERCK INDEX
M970
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY Merck Index
NCI_THESAURUS
C81546
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
EVMPD
SUB11142MIG
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110923
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
PUBCHEM
25315
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
INN
1753
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
CAS
15301-93-6
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
WIKIPEDIA
TOFENACIN
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
FDA UNII
C4A112M10H
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
DRUG CENTRAL
2692
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID50864578
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
MESH
C005834
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
SMS_ID
100000077748
Created by admin on Thu Jul 06 01:41:13 UTC 2023 , Edited by admin on Thu Jul 06 01:41:13 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY