(2E)-3-(3,4-dimethoxyphenyl)-3-oxidanylidene-2-(2-oxidanylidene-4H-1,4-benzoxazin-3-ylidene)propanoic acid

Systemtic Name: (2E)-3-(3,4-dimethoxyphenyl)-3-oxidanylidene-2-(2-oxidanylidene-4H-1,4-benzoxazin-3-ylidene)propanoic acid Openeye Name: (2E)-3-(3,4-dimethoxyphenyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid CAS Name: (2E)-3-(3,4-dimethoxyphenyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid IUPAC Name: (2E)-3-(3,4-dimethoxyphenyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid Traditional Name: (2E)-3-(3,4-dimethoxyphenyl)-3-keto-2-(2-keto-4H-1,4-benzoxazin-3-ylidene)propionic acid Formula: C19H15NO7 MolecularWeight: 369.3249

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(=C2C(=O)OC3=CC=CC=C3N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C(=C\2/C(=O)OC3=CC=CC=C3N2)/C(=O)O)OC

InChI

InChI=1S/C19H15NO7/c1-25-13-8-7-10(9-14(13)26-2)17(21)15(18(22)23)16-19(24)27-12-6-4-3-5-11(12)20-16/h3-9,20H,1-2H3,(H,22,23)/b16-15+