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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H13NO4
Molecular Weight 295.2894
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-[Methoxy(phenyl)methylidene]-2-oxo-1H-indole-6-carboxylic acid, (3E)-

SMILES

CO\C(=C1\C(=O)NC2=C1C=CC(=C2)C(O)=O)C3=CC=CC=C3

InChI

InChIKey=QEQIWWJFXFJXED-CCEZHUSRSA-N
InChI=1S/C17H13NO4/c1-22-15(10-5-3-2-4-6-10)14-12-8-7-11(17(20)21)9-13(12)18-16(14)19/h2-9H,1H3,(H,18,19)(H,20,21)/b15-14+

HIDE SMILES / InChI

Molecular Formula C17H13NO4
Molecular Weight 295.2894
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 19:15:21 GMT 2025
Edited
by admin
on Wed Apr 02 19:15:21 GMT 2025
Record UNII
RYN3E64A8L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3E)-3-[Methoxy(phenyl)methylidene]-2-oxo-1H-indole-6-carboxylic acid
Preferred Name English
3-[Methoxy(phenyl)methylidene]-2-oxo-1H-indole-6-carboxylic acid, (3E)-
Systematic Name English
Code System Code Type Description
FDA UNII
RYN3E64A8L
Created by admin on Wed Apr 02 19:15:21 GMT 2025 , Edited by admin on Wed Apr 02 19:15:21 GMT 2025
PRIMARY
PUBCHEM
70937134
Created by admin on Wed Apr 02 19:15:21 GMT 2025 , Edited by admin on Wed Apr 02 19:15:21 GMT 2025
PRIMARY