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Details

Stereochemistry ACHIRAL
Molecular Formula C11H13NO
Molecular Weight 175.227
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-(2-Methylphenyl)-2-butenamide, (2E)-

SMILES

C\C=C\C(=O)NC1=CC=CC=C1C

InChI

InChIKey=UQAKKCXZGIJXLU-ZZXKWVIFSA-N
InChI=1S/C11H13NO/c1-3-6-11(13)12-10-8-5-4-7-9(10)2/h3-8H,1-2H3,(H,12,13)/b6-3+

HIDE SMILES / InChI

Molecular Formula C11H13NO
Molecular Weight 175.227
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:40:34 GMT 2025
Edited
by admin
on Wed Apr 02 17:40:34 GMT 2025
Record UNII
V39449AG5J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CROTAMITON IMPURITY C [EP IMPURITY]
Preferred Name English
N-(2-Methylphenyl)-2-butenamide, (2E)-
Systematic Name English
(2E)-N-(2-methylphenyl)but-2-enamide
Systematic Name English
(2E)-N-(2-Methylphenyl)-2-butenamide
Systematic Name English
Code System Code Type Description
CAS
2196187-17-2
Created by admin on Wed Apr 02 17:40:34 GMT 2025 , Edited by admin on Wed Apr 02 17:40:34 GMT 2025
PRIMARY
PUBCHEM
12940469
Created by admin on Wed Apr 02 17:40:34 GMT 2025 , Edited by admin on Wed Apr 02 17:40:34 GMT 2025
PRIMARY
FDA UNII
V39449AG5J
Created by admin on Wed Apr 02 17:40:34 GMT 2025 , Edited by admin on Wed Apr 02 17:40:34 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY