diethyl 2-(1,3-benzodioxol-5-yl)propanedioate

Systemtic Name: diethyl 2-(1,3-benzodioxol-5-yl)propanedioate Openeye Name: diethyl 2-(1,3-benzodioxol-5-yl)propanedioate CAS Name: 2-(1,3-benzodioxol-5-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,3-benzodioxol-5-yl)propanedioate Traditional Name: 2-(1,3-benzodioxol-5-yl)malonic acid diethyl ester Formula: C14H16O6 MolecularWeight: 280.27324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O6/c1-3-17-13(15)12(14(16)18-4-2)9-5-6-10-11(7-9)20-8-19-10/h5-7,12H,3-4,8H2,1-2H3