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Details

Stereochemistry ACHIRAL
Molecular Formula C12H17NO2
Molecular Weight 207.2689
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTALAMIDE

SMILES

CCCCCOC1=C(C=CC=C1)C(N)=O

InChI

InChIKey=UHYJMNVCANOFPF-UHFFFAOYSA-N
InChI=1S/C12H17NO2/c1-2-3-6-9-15-11-8-5-4-7-10(11)12(13)14/h4-5,7-8H,2-3,6,9H2,1H3,(H2,13,14)

HIDE SMILES / InChI

Molecular Formula C12H17NO2
Molecular Weight 207.2689
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 14:58:47 UTC 2023
Edited
by admin
on Fri Dec 15 14:58:47 UTC 2023
Record UNII
6SK5U4T31I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTALAMIDE
INN  
INN  
Official Name English
HESTAR
Brand Name English
pentalamide [INN]
Common Name English
O-(PENTYLOXY)BENZAMIDE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C514
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
Code System Code Type Description
EVMPD
SUB09680MIG
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
FDA UNII
6SK5U4T31I
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
INN
1376
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
EPA CompTox
DTXSID10204350
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
PUBCHEM
71661
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
ECHA (EC/EINECS)
226-960-2
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
CAS
5579-06-6
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
SMS_ID
100000082487
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
NCI_THESAURUS
C81506
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105369
Created by admin on Fri Dec 15 14:58:48 UTC 2023 , Edited by admin on Fri Dec 15 14:58:48 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY