(E)-4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxidanylidene-propyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxidanylidene-propyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxo-propyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[1-(3,4-dimethoxyphenyl)-3-keto-3-methoxy-propyl]amino]-4-keto-but-2-enoic acid Formula: C16H19NO7 MolecularWeight: 337.32456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C=CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)/C=C/C(=O)O)OC

InChI

InChI=1S/C16H19NO7/c1-22-12-5-4-10(8-13(12)23-2)11(9-16(21)24-3)17-14(18)6-7-15(19)20/h4-8,11H,9H2,1-3H3,(H,17,18)(H,19,20)/b7-6+