dimethyl 4-cyano-4-(4-fluorophenyl)heptanedioate

Systemtic Name: dimethyl 4-cyano-4-(4-fluorophenyl)heptanedioate Openeye Name: dimethyl 4-cyano-4-(4-fluorophenyl)heptanedioate CAS Name: 4-cyano-4-(4-fluorophenyl)heptanedioic acid dimethyl ester IUPAC Name: dimethyl 4-cyano-4-(4-fluorophenyl)heptanedioate Traditional Name: 4-cyano-4-(4-fluorophenyl)pimelic acid dimethyl ester Formula: C16H18FNO4 MolecularWeight: 307.316823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18FNO4/c1-21-14(19)7-9-16(11-18,10-8-15(20)22-2)12-3-5-13(17)6-4-12/h3-6H,7-10H2,1-2H3