methyl (E)-2-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)carbonyl-4-(4-methylphenyl)but-3-enoate

Systemtic Name: methyl (E)-2-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)carbonyl-4-(4-methylphenyl)but-3-enoate Openeye Name: methyl (E)-2-(1,3-benzodioxol-5-yl)-3-(4-methoxybenzoyl)-4-(p-tolyl)but-3-enoate CAS Name: (E)-2-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)-oxomethyl]-4-(4-methylphenyl)-3-butenoic acid methyl ester IUPAC Name: methyl (E)-2-(1,3-benzodioxol-5-yl)-3-(4-methoxybenzoyl)-4-(4-methylphenyl)but-3-enoate Traditional Name: (E)-2-(1,3-benzodioxol-5-yl)-3-p-anisoyl-4-(p-tolyl)but-3-enoic acid methyl ester Formula: C27H24O6 MolecularWeight: 444.47586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C(C2=CC3=C(C=C2)OCO3)C(=O)OC)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C(C2=CC3=C(C=C2)OCO3)C(=O)OC)/C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H24O6/c1-17-4-6-18(7-5-17)14-22(26(28)19-8-11-21(30-2)12-9-19)25(27(29)31-3)20-10-13-23-24(15-20)33-16-32-23/h4-15,25H,16H2,1-3H3/b22-14+