ethyl 3-(1,3-benzodioxol-5-yl)-3-oxidanyl-3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: ethyl 3-(1,3-benzodioxol-5-yl)-3-oxidanyl-3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: ethyl 3-(1,3-benzodioxol-5-yl)-3-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzodioxol-5-yl)-3-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-3-(3,4,5-trimethoxyphenyl)propionic acid ethyl ester Formula: C21H24O8 MolecularWeight: 404.41046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24O8/c1-5-27-19(22)11-21(23,13-6-7-15-16(8-13)29-12-28-15)14-9-17(24-2)20(26-4)18(10-14)25-3/h6-10,23H,5,11-12H2,1-4H3