2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(3-oxo-4H-quinoxalin-2-yl)indol-1-yl]acetic acid CAS Name: 2-[3-(3-oxo-4H-quinoxalin-2-yl)-1-indolyl]acetic acid IUPAC Name: 2-[3-(3-oxo-4H-quinoxalin-2-yl)indol-1-yl]acetic acid Traditional Name: 2-[3-(3-keto-4H-quinoxalin-2-yl)indol-1-yl]acetic acid Formula: C18H13N3O3 MolecularWeight: 319.31412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC(=O)O)C3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC(=O)O)C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C18H13N3O3/c22-16(23)10-21-9-12(11-5-1-4-8-15(11)21)17-18(24)20-14-7-3-2-6-13(14)19-17/h1-9H,10H2,(H,20,24)(H,22,23)