methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxidanylidene-3-[(2,4,5-trimethoxyphenyl)methyl]but-2-enoate

Systemtic Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxidanylidene-3-[(2,4,5-trimethoxyphenyl)methyl]but-2-enoate Openeye Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(2,4,5-trimethoxyphenyl)methyl]but-2-enoate CAS Name: (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(2,4,5-trimethoxyphenyl)methyl]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(2,4,5-trimethoxyphenyl)methyl]but-2-enoate Traditional Name: (Z)-2-(1,3-benzodioxol-5-yl)-4-keto-4-(4-methoxyphenyl)-3-(2,4,5-trimethoxybenzyl)but-2-enoic acid methyl ester Formula: C29H28O9 MolecularWeight: 520.52722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC(=C(C=C4OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(/C2=CC3=C(C=C2)OCO3)\C(=O)OC)/CC4=CC(=C(C=C4OC)OC)OC

InChI

InChI=1S/C29H28O9/c1-32-20-9-6-17(7-10-20)28(30)21(12-19-14-24(34-3)25(35-4)15-23(19)33-2)27(29(31)36-5)18-8-11-22-26(13-18)38-16-37-22/h6-11,13-15H,12,16H2,1-5H3/b27-21-