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Details

Stereochemistry RACEMIC
Molecular Formula C20H23NO3
Molecular Weight 325.4015
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRICLAZATE

SMILES

CN1CCC(COC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3)C1

InChI

InChIKey=DSSLNDPHTMNIHL-UHFFFAOYSA-N
InChI=1S/C20H23NO3/c1-21-13-12-16(14-21)15-24-19(22)20(23,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,23H,12-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C20H23NO3
Molecular Weight 325.4015
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:36:30 GMT 2023
Edited
by admin
on Fri Dec 15 15:36:30 GMT 2023
Record UNII
4661WA7OCU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRICLAZATE
INN  
INN  
Official Name English
(±)-1-METHYL-3-PYRROLIDINEMETHANOL BENZILATE ESTER
Common Name English
BENZILIC ACID, (1-METHYL-3-PYRROLIDINYL)METHYL ESTER
Common Name English
triclazate [INN]
Common Name English
1-METHYL-3-PYRROLIDINEMETHANOL BENZILATE ESTER, (±)-
Common Name English
3-PYRROLIDINEMETHANOL, 1-METHYL-, BENZILATE
Systematic Name English
NSC-172212
Code English
TCMDC-131375
Code English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID00863990
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
NCI_THESAURUS
C75288
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
CAS
7009-76-9
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
ChEMBL
CHEMBL534388
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
FDA UNII
4661WA7OCU
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
INN
877
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
PUBCHEM
214358
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
EVMPD
SUB11269MIG
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
NSC
172212
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
SMS_ID
100000077517
Created by admin on Fri Dec 15 15:36:30 GMT 2023 , Edited by admin on Fri Dec 15 15:36:30 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY