dimethyl 3-cyano-3-(3,4-dichlorophenyl)pentanedioate

Systemtic Name: dimethyl 3-cyano-3-(3,4-dichlorophenyl)pentanedioate Openeye Name: dimethyl 3-cyano-3-(3,4-dichlorophenyl)pentanedioate CAS Name: 3-cyano-3-(3,4-dichlorophenyl)pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-cyano-3-(3,4-dichlorophenyl)pentanedioate Traditional Name: 3-cyano-3-(3,4-dichlorophenyl)glutaric acid dimethyl ester Formula: C14H13Cl2NO4 MolecularWeight: 330.16332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)OC)(C#N)C1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)CC(CC(=O)OC)(C#N)C1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H13Cl2NO4/c1-20-12(18)6-14(8-17,7-13(19)21-2)9-3-4-10(15)11(16)5-9/h3-5H,6-7H2,1-2H3