4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-4-oxo-but-2-enoic acid CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-4-oxo-2-butenoic acid IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-4-oxobut-2-enoic acid Traditional Name: 4-(homoveratrylamino)-4-keto-3-methyl-but-2-enoic acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C(=O)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(=CC(=O)O)C(=O)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C15H19NO5/c1-10(8-14(17)18)15(19)16-7-6-11-4-5-12(20-2)13(9-11)21-3/h4-5,8-9H,6-7H2,1-3H3,(H,16,19)(H,17,18)