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

Systemtic Name: diethyl 2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methyl]propanedioate Openeye Name: diethyl 2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methyl]propanedioate CAS Name: 2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methyl]propanedioate Traditional Name: 2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methyl]malonic acid diethyl ester Formula: C17H22O6 MolecularWeight: 322.35298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)OC(O2)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)OC(O2)(C)C)C(=O)OCC

InChI

InChI=1S/C17H22O6/c1-5-20-15(18)12(16(19)21-6-2)9-11-7-8-13-14(10-11)23-17(3,4)22-13/h7-8,10,12H,5-6,9H2,1-4H3