3-(6,7-dimethoxy-3-oxidanylidene-4H-quinoxalin-2-yl)propanoic acid

Systemtic Name: 3-(6,7-dimethoxy-3-oxidanylidene-4H-quinoxalin-2-yl)propanoic acid Openeye Name: 3-(6,7-dimethoxy-3-oxo-4H-quinoxalin-2-yl)propanoic acid CAS Name: 3-(6,7-dimethoxy-3-oxo-4H-quinoxalin-2-yl)propanoic acid IUPAC Name: 3-(6,7-dimethoxy-3-oxo-4H-quinoxalin-2-yl)propanoic acid Traditional Name: 3-(3-keto-6,7-dimethoxy-4H-quinoxalin-2-yl)propionic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)NC(=O)C(=N2)CCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)NC(=O)C(=N2)CCC(=O)O)OC

InChI

InChI=1S/C13H14N2O5/c1-19-10-5-8-9(6-11(10)20-2)15-13(18)7(14-8)3-4-12(16)17/h5-6H,3-4H2,1-2H3,(H,15,18)(H,16,17)