(E)-4-[cyclopropyl-[(3,4-dimethoxyphenyl)methyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[cyclopropyl-[(3,4-dimethoxyphenyl)methyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[cyclopropyl-[(3,4-dimethoxyphenyl)methyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[cyclopropyl-[(3,4-dimethoxyphenyl)methyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[cyclopropyl-[(3,4-dimethoxyphenyl)methyl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[cyclopropyl(veratryl)amino]-4-keto-but-2-enoic acid Formula: C16H19NO5 MolecularWeight: 305.32576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C2CC2)C(=O)C=CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C2CC2)C(=O)/C=C/C(=O)O)OC

InChI

InChI=1S/C16H19NO5/c1-21-13-6-3-11(9-14(13)22-2)10-17(12-4-5-12)15(18)7-8-16(19)20/h3,6-9,12H,4-5,10H2,1-2H3,(H,19,20)/b8-7+