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Details

Stereochemistry ACHIRAL
Molecular Formula C20H17NO5
Molecular Weight 351.3527
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Methyl (3E)-1-acetyl-2,3-dihydro-3-(methoxyphenylmethylene)-2-oxo-1H-indole-6-carboxylate

SMILES

COC(=O)C1=CC=C2C(=C1)N(C(C)=O)C(=O)\C2=C(\OC)C3=CC=CC=C3

InChI

InChIKey=IAELOHNWFVWCNO-ISLYRVAYSA-N
InChI=1S/C20H17NO5/c1-12(22)21-16-11-14(20(24)26-3)9-10-15(16)17(19(21)23)18(25-2)13-7-5-4-6-8-13/h4-11H,1-3H3/b18-17+

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Methyl (3E)-1-acetyl-2,3-dihydro-3-(methoxyphenylmethylene)-2-oxo-1H-indole-6-carboxylate
Systematic Name English
1H-Indole-6-carboxylic acid, 1-acetyl-2,3-dihydro-3-(methoxyphenylmethylene)-2-oxo-, methyl ester, (3E)-
Systematic Name English
Code System Code Type Description
FDA UNII
W85Q6GG97H
Created by admin on Sat Dec 16 19:55:38 GMT 2023 , Edited by admin on Sat Dec 16 19:55:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID401122706
Created by admin on Sat Dec 16 19:55:38 GMT 2023 , Edited by admin on Sat Dec 16 19:55:38 GMT 2023
PRIMARY
CAS
1168152-07-5
Created by admin on Sat Dec 16 19:55:38 GMT 2023 , Edited by admin on Sat Dec 16 19:55:38 GMT 2023
PRIMARY
PUBCHEM
44190180
Created by admin on Sat Dec 16 19:55:38 GMT 2023 , Edited by admin on Sat Dec 16 19:55:38 GMT 2023
PRIMARY
NIH
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