methyl 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-oxo-butanoate CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-oxobutanoate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(2,4-dimethoxyphenyl)-4-keto-butyric acid methyl ester Formula: C20H20O7 MolecularWeight: 372.3686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O7/c1-23-13-5-6-14(18(9-13)24-2)16(21)10-15(20(22)25-3)12-4-7-17-19(8-12)27-11-26-17/h4-9,15H,10-11H2,1-3H3