diethyl 2-[1,3-benzodioxol-5-yl(oxidanyl)methyl]-3-(phenylcarbonyl)butanedioate

Systemtic Name: diethyl 2-[1,3-benzodioxol-5-yl(oxidanyl)methyl]-3-(phenylcarbonyl)butanedioate Openeye Name: diethyl 2-[1,3-benzodioxol-5-yl(hydroxy)methyl]-3-benzoyl-butanedioate CAS Name: 2-[1,3-benzodioxol-5-yl(hydroxy)methyl]-3-benzoylbutanedioic acid diethyl ester IUPAC Name: diethyl 2-[1,3-benzodioxol-5-yl(hydroxy)methyl]-3-benzoylbutanedioate Traditional Name: 2-[1,3-benzodioxol-5-yl(hydroxy)methyl]-3-benzoyl-succinic acid diethyl ester Formula: C23H24O8 MolecularWeight: 428.43186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24O8/c1-3-28-22(26)18(20(24)14-8-6-5-7-9-14)19(23(27)29-4-2)21(25)15-10-11-16-17(12-15)31-13-30-16/h5-12,18-19,21,25H,3-4,13H2,1-2H3