2-[[(7E)-6-oxidanylidene-7-(1H-pyridin-2-ylidene)quinoxalin-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[(7E)-6-oxidanylidene-7-(1H-pyridin-2-ylidene)quinoxalin-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[(7E)-6-oxo-7-(1H-pyridin-2-ylidene)quinoxaline-5-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[(7E)-6-oxo-7-(1H-pyridin-2-ylidene)-5-quinoxalinyl]methyl]amino]acetic acid IUPAC Name: 2-[[(7E)-6-oxo-7-(1H-pyridin-2-ylidene)quinoxaline-5-carbonyl]amino]acetic acid Traditional Name: 2-[[(7E)-6-keto-7-(1H-pyridin-2-ylidene)quinoxaline-5-carbonyl]amino]acetic acid Formula: C16H12N4O4 MolecularWeight: 324.29088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C3C(=C(C2=O)C(=O)NCC(=O)O)N=CC=N3)NC=C1

Isomeric SMILES

C1=C/C(=C\2/C=C3C(=C(C2=O)C(=O)NCC(=O)O)N=CC=N3)/NC=C1

InChI

InChI=1S/C16H12N4O4/c21-12(22)8-20-16(24)13-14-11(18-5-6-19-14)7-9(15(13)23)10-3-1-2-4-17-10/h1-7,17H,8H2,(H,20,24)(H,21,22)/b10-9+