4-[[4-chloranyl-2-(3-oxidanylidene-4H-quinoxalin-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-chloranyl-2-(3-oxidanylidene-4H-quinoxalin-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)anilino]-4-oxo-butanoic acid CAS Name: 4-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-[4-chloro-2-(3-keto-4H-quinoxalin-2-yl)anilino]-4-keto-butyric acid Formula: C18H14ClN3O4 MolecularWeight: 371.77446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)C3=C(C=CC(=C3)Cl)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)C3=C(C=CC(=C3)Cl)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H14ClN3O4/c19-10-5-6-12(20-15(23)7-8-16(24)25)11(9-10)17-18(26)22-14-4-2-1-3-13(14)21-17/h1-6,9H,7-8H2,(H,20,23)(H,22,26)(H,24,25)