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

Systemtic Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)ethyl]propanedioate Openeye Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)ethyl]propanedioate CAS Name: 2-[1-(1,3-benzodioxol-5-yl)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)ethyl]propanedioate Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)ethyl]malonic acid diethyl ester Formula: C16H20O6 MolecularWeight: 308.3264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O6/c1-4-19-15(17)14(16(18)20-5-2)10(3)11-6-7-12-13(8-11)22-9-21-12/h6-8,10,14H,4-5,9H2,1-3H3