diethyl 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]propanedioate

Systemtic Name: diethyl 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]propanedioate Openeye Name: diethyl 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]propanedioate CAS Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]propanedioate Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]malonic acid diethyl ester Formula: C15H17ClO6 MolecularWeight: 328.74488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1Cl)OCO2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1Cl)OCO2)C(=O)OCC

InChI

InChI=1S/C15H17ClO6/c1-3-19-14(17)10(15(18)20-4-2)5-9-6-12-13(7-11(9)16)22-8-21-12/h6-7,10H,3-5,8H2,1-2H3