cyanomethyl 4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: cyanomethyl 4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: cyanomethyl 1-(benzenesulfonyl)-4-phenyl-piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-phenyl-4-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(benzenesulfonyl)-4-phenylpiperidine-4-carboxylate Traditional Name: 1-besyl-4-phenyl-isonipecotic acid cyanomethyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCC#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCC#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S/c21-13-16-26-19(23)20(17-7-3-1-4-8-17)11-14-22(15-12-20)27(24,25)18-9-5-2-6-10-18/h1-10H,11-12,14-16H2