(E)-4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-4-phenyl-but-3-enoic acid

Systemtic Name: (E)-4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-4-phenyl-but-3-enoic acid Openeye Name: (E)-4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-4-phenyl-but-3-enoic acid CAS Name: (E)-4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-4-phenyl-3-butenoic acid IUPAC Name: (E)-4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-4-phenylbut-3-enoic acid Traditional Name: (E)-3-carbethoxy-4-(3,4-dimethoxyphenyl)-4-phenyl-but-3-enoic acid Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC(=C(C=C2)OC)OC)CC(=O)O

Isomeric SMILES

CCOC(=O)/C(=C(\C1=CC=CC=C1)/C2=CC(=C(C=C2)OC)OC)/CC(=O)O

InChI

InChI=1S/C21H22O6/c1-4-27-21(24)16(13-19(22)23)20(14-8-6-5-7-9-14)15-10-11-17(25-2)18(12-15)26-3/h5-12H,4,13H2,1-3H3,(H,22,23)/b20-16+