ethyl 2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-3-(3,4,5-trimethoxyphenyl)butanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC2=C(C=C1)OCO2)C(C=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C(C1=CC2=C(C=C1)OCO2)C(C=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H24O8/c1-5-28-22(24)20(13-6-7-16-17(8-13)30-12-29-16)15(11-23)14-9-18(25-2)21(27-4)19(10-14)26-3/h6-11,15,20H,5,12H2,1-4H3