(phenylmethyl) 4-(4-chloranyl-2-cyano-phenyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-chloranyl-2-cyano-phenyl)piperidine-1-carboxylate Openeye Name: benzyl 4-(4-chloro-2-cyano-phenyl)piperidine-1-carboxylate CAS Name: 4-(4-chloro-2-cyanophenyl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-chloro-2-cyanophenyl)piperidine-1-carboxylate Traditional Name: 4-(4-chloro-2-cyano-phenyl)piperidine-1-carboxylic acid benzyl ester Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=C(C=C(C=C2)Cl)C#N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C2=C(C=C(C=C2)Cl)C#N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H19ClN2O2/c21-18-6-7-19(17(12-18)13-22)16-8-10-23(11-9-16)20(24)25-14-15-4-2-1-3-5-15/h1-7,12,16H,8-11,14H2