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Details

Stereochemistry ACHIRAL
Molecular Formula C7H13NO2
Molecular Weight 143.1836
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Methyl (2E)-4-(dimethylamino)-2-butenoate

SMILES

COC(=O)\C=C\CN(C)C

InChI

InChIKey=CIBYNORTVQSQMW-SNAWJCMRSA-N
InChI=1S/C7H13NO2/c1-8(2)6-4-5-7(9)10-3/h4-5H,6H2,1-3H3/b5-4+

HIDE SMILES / InChI

Molecular Formula C7H13NO2
Molecular Weight 143.1836
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 13:29:07 GMT 2025
Edited
by admin
on Wed Apr 02 13:29:07 GMT 2025
Record UNII
A949DW99CZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Butenoic acid, 4-(dimethylamino)-, methyl ester, (2E)-
Preferred Name English
Methyl (2E)-4-(dimethylamino)-2-butenoate
Systematic Name English
Code System Code Type Description
CAS
212776-19-7
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
FDA UNII
A949DW99CZ
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
PUBCHEM
15870798
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT