(E)-4-[(3,4-dimethoxyphenyl)methylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3,4-dimethoxyphenyl)methylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3,4-dimethoxyphenyl)methylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3,4-dimethoxyphenyl)methylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3,4-dimethoxyphenyl)methylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(veratrylamino)but-2-enoic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)/C=C/C(=O)O)OC

InChI

InChI=1S/C13H15NO5/c1-18-10-4-3-9(7-11(10)19-2)8-14-12(15)5-6-13(16)17/h3-7H,8H2,1-2H3,(H,14,15)(H,16,17)/b6-5+