dimethyl 2-cyano-3-(4-fluorophenyl)pentanedioate

Systemtic Name: dimethyl 2-cyano-3-(4-fluorophenyl)pentanedioate Openeye Name: dimethyl 2-cyano-3-(4-fluorophenyl)pentanedioate CAS Name: 2-cyano-3-(4-fluorophenyl)pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-cyano-3-(4-fluorophenyl)pentanedioate Traditional Name: 2-cyano-3-(4-fluorophenyl)glutaric acid dimethyl ester Formula: C14H14FNO4 MolecularWeight: 279.263663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14FNO4/c1-19-13(17)7-11(12(8-16)14(18)20-2)9-3-5-10(15)6-4-9/h3-6,11-12H,7H2,1-2H3