methyl 4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methyl]butanoate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methyl]butanoate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-4-oxo-2-[(3,4,5-trimethoxyphenyl)methyl]butanoate CAS Name: 4-(1,3-benzodioxol-5-yl)-4-oxo-2-[(3,4,5-trimethoxyphenyl)methyl]butanoic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-4-oxo-2-[(3,4,5-trimethoxyphenyl)methyl]butanoate Traditional Name: 4-(1,3-benzodioxol-5-yl)-4-keto-2-(3,4,5-trimethoxybenzyl)butyric acid methyl ester Formula: C22H24O8 MolecularWeight: 416.42116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(CC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(CC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

InChI

InChI=1S/C22H24O8/c1-25-19-8-13(9-20(26-2)21(19)27-3)7-15(22(24)28-4)10-16(23)14-5-6-17-18(11-14)30-12-29-17/h5-6,8-9,11,15H,7,10,12H2,1-4H3