(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H25NO5S/c1-18-6-10-23(11-7-18)32(29,30)26-14-12-20(13-15-26)25(28)31-17-24(27)22-9-8-19-4-2-3-5-21(19)16-22/h2-11,16,20H,12-15,17H2,1H3