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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17NO2
Molecular Weight 231.2903
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of METHYL 2-(2-HEXENYLIDENEAMINO)BENZOATE

SMILES

CCC\C=C\C=N\C1=CC=CC=C1C(=O)OC

InChI

InChIKey=IGAVEPCBGZDTJY-DVVLCRQDSA-N
InChI=1S/C14H17NO2/c1-3-4-5-8-11-15-13-10-7-6-9-12(13)14(16)17-2/h5-11H,3-4H2,1-2H3/b8-5+,15-11+

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
METHYL 2-(2-HEXENYLIDENEAMINO)BENZOATE
Systematic Name English
BENZOIC ACID, 2-(2-HEXENYLIDENEAMINO)-, METHYL ESTER
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID6071617
Created by admin on Tue Apr 01 17:45:35 GMT 2025 , Edited by admin on Tue Apr 01 17:45:35 GMT 2025
PRIMARY
CAS
68527-80-0
Created by admin on Tue Apr 01 17:45:35 GMT 2025 , Edited by admin on Tue Apr 01 17:45:35 GMT 2025
PRIMARY
FDA UNII
B8N4ZQ87S6
Created by admin on Tue Apr 01 17:45:35 GMT 2025 , Edited by admin on Tue Apr 01 17:45:35 GMT 2025
PRIMARY
ECHA (EC/EINECS)
271-285-9
Created by admin on Tue Apr 01 17:45:35 GMT 2025 , Edited by admin on Tue Apr 01 17:45:35 GMT 2025
PRIMARY
NIH
NCATS
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