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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H17NO
Molecular Weight 203.2802
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ETHYL-N-(2-METHYLPHENYL)-3-BUTENAMIDE

SMILES

CCN(C(=O)CC=C)C1=C(C)C=CC=C1

InChI

InChIKey=NXXVQNLYGNUDLL-UHFFFAOYSA-N
InChI=1S/C13H17NO/c1-4-8-13(15)14(5-2)12-10-7-6-9-11(12)3/h4,6-7,9-10H,1,5,8H2,2-3H3

HIDE SMILES / InChI

Molecular Formula C13H17NO
Molecular Weight 203.2802
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 Sat Dec 16 18:26:25 UTC 2023
Edited
by admin
on Sat Dec 16 18:26:25 UTC 2023
Record UNII
Q938DXH5MS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ETHYL-N-(2-METHYLPHENYL)-3-BUTENAMIDE
Systematic Name English
3-BUTENAMIDE, N-ETHYL-N-(2-METHYLPHENYL)-
Systematic Name English
CROTAMITON IMPURITY A [EP IMPURITY]
Common Name English
N-ETHYL-N-(2-METHYLPHENYL)BUT-3-ENAMIDE
Systematic Name English
3-BUTENO-O-TOLUIDIDE, N-ETHYL-
Common Name English
Code System Code Type Description
FDA UNII
Q938DXH5MS
Created by admin on Sat Dec 16 18:26:25 UTC 2023 , Edited by admin on Sat Dec 16 18:26:25 UTC 2023
PRIMARY
PUBCHEM
118832936
Created by admin on Sat Dec 16 18:26:25 UTC 2023 , Edited by admin on Sat Dec 16 18:26:25 UTC 2023
PRIMARY
CAS
13936-71-5
Created by admin on Sat Dec 16 18:26:25 UTC 2023 , Edited by admin on Sat Dec 16 18:26:25 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP