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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H24ClNO3.ClH
Molecular Weight 446.366
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENICLOBRATE HYDROCHLORIDE, (S)-

SMILES

Cl.CC[C@@](C)(OC1=CC=C(CC2=CC=C(Cl)C=C2)C=C1)C(=O)OCC3=CC=CN=C3

InChI

InChIKey=VBVISAJRRRZAKV-GJFSDDNBSA-N
InChI=1S/C24H24ClNO3.ClH/c1-3-24(2,23(27)28-17-20-5-4-14-26-16-20)29-22-12-8-19(9-13-22)15-18-6-10-21(25)11-7-18;/h4-14,16H,3,15,17H2,1-2H3;1H/t24-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C24H24ClNO3
Molecular Weight 409.905
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:35:37 GMT 2025
Edited
by admin
on Mon Mar 31 23:35:37 GMT 2025
Record UNII
OW2YG4M71Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENICLOBRATE HYDROCHLORIDE, (S)-
Common Name English
BUTANOIC ACID, 2-(4-((4-CHLOROPHENYL)METHYL)PHENOXY)-2-METHYL-, 3-PYRIDINYLMETHYL ESTER, HYDROCHLORIDE, (S)-
Preferred Name English
Code System Code Type Description
PUBCHEM
91864986
Created by admin on Mon Mar 31 23:35:37 GMT 2025 , Edited by admin on Mon Mar 31 23:35:37 GMT 2025
PRIMARY
FDA UNII
OW2YG4M71Y
Created by admin on Mon Mar 31 23:35:37 GMT 2025 , Edited by admin on Mon Mar 31 23:35:37 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER