methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)but-2-enoate

Systemtic Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)but-2-enoate Openeye Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-3-benzyl-4-(3,4-dimethoxyphenyl)-4-oxo-but-2-enoate CAS Name: (Z)-2-(1,3-benzodioxol-5-yl)-4-(3,4-dimethoxyphenyl)-4-oxo-3-(phenylmethyl)-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-3-benzyl-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoate Traditional Name: (Z)-2-(1,3-benzodioxol-5-yl)-3-benzyl-4-(3,4-dimethoxyphenyl)-4-keto-but-2-enoic acid methyl ester Formula: C27H24O7 MolecularWeight: 460.47526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(=C(C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C(=C(/C2=CC3=C(C=C2)OCO3)\C(=O)OC)/CC4=CC=CC=C4)OC

InChI

InChI=1S/C27H24O7/c1-30-21-11-10-19(15-23(21)31-2)26(28)20(13-17-7-5-4-6-8-17)25(27(29)32-3)18-9-12-22-24(14-18)34-16-33-22/h4-12,14-15H,13,16H2,1-3H3/b25-20-