methyl 1-[2-[(phenylmethyl)-(phenylsulfonyl)amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(phenylmethyl)-(phenylsulfonyl)amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[2-[benzenesulfonyl(benzyl)amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-[benzenesulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[benzenesulfonyl(benzyl)amino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[benzyl(besyl)amino]benzoyl]isonipecotic acid methyl ester Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2N(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2N(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O5S/c1-34-27(31)22-16-18-28(19-17-22)26(30)24-14-8-9-15-25(24)29(20-21-10-4-2-5-11-21)35(32,33)23-12-6-3-7-13-23/h2-15,22H,16-20H2,1H3