[4-(4-cyanophenyl)phenyl] (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(benzenesulfonyl)-2-piperidinecarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: (2R)-1-besylpipecolinic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN([C@H](C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S/c26-18-19-9-11-20(12-10-19)21-13-15-22(16-14-21)31-25(28)24-8-4-5-17-27(24)32(29,30)23-6-2-1-3-7-23/h1-3,6-7,9-16,24H,4-5,8,17H2/t24-/m1/s1