2-[(6-oxidanylidene-3-phenyl-7-pyridin-2-yl-4H-quinoxalin-5-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(6-oxidanylidene-3-phenyl-7-pyridin-2-yl-4H-quinoxalin-5-yl)carbonylamino]ethanoic acid Openeye Name: 2-[[6-oxo-3-phenyl-7-(2-pyridyl)-4H-quinoxaline-5-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[6-oxo-3-phenyl-7-(2-pyridinyl)-4H-quinoxalin-5-yl]methyl]amino]acetic acid IUPAC Name: 2-[(6-oxo-3-phenyl-7-pyridin-2-yl-4H-quinoxaline-5-carbonyl)amino]acetic acid Traditional Name: 2-[[6-keto-3-phenyl-7-(2-pyridyl)-4H-quinoxaline-5-carbonyl]amino]acetic acid Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C3C=C(C(=O)C(=C3N2)C(=O)NCC(=O)O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C3C=C(C(=O)C(=C3N2)C(=O)NCC(=O)O)C4=CC=CC=N4

InChI

InChI=1S/C22H16N4O4/c27-18(28)12-25-22(30)19-20-16(10-14(21(19)29)15-8-4-5-9-23-15)24-11-17(26-20)13-6-2-1-3-7-13/h1-11,26H,12H2,(H,25,30)(H,27,28)