[(1S)-2-oxidanylidene-1,2-diphenyl-ethyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(1S)-2-oxidanylidene-1,2-diphenyl-ethyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(1S)-2-oxo-1,2-diphenyl-ethyl] 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid [(1S)-2-oxo-1,2-diphenylethyl] ester IUPAC Name: [(1S)-2-oxo-1,2-diphenylethyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid [(1S)-2-keto-1,2-diphenyl-ethyl] ester Formula: C27H27NO5S MolecularWeight: 477.57198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)O[C@@H](C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27NO5S/c1-20-12-14-24(15-13-20)34(31,32)28-18-16-23(17-19-28)27(30)33-26(22-10-6-3-7-11-22)25(29)21-8-4-2-5-9-21/h2-15,23,26H,16-19H2,1H3/t26-/m0/s1