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

Systemtic Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)prop-2-enyl]propanedioate Openeye Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)allyl]propanedioate CAS Name: 2-[1-(1,3-benzodioxol-5-yl)prop-2-enyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-(1,3-benzodioxol-5-yl)prop-2-enyl]propanedioate Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)allyl]malonic acid diethyl ester Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O6/c1-4-12(11-7-8-13-14(9-11)23-10-22-13)15(16(18)20-5-2)17(19)21-6-3/h4,7-9,12,15H,1,5-6,10H2,2-3H3