[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C23H27NO5S/c1-16-13-18(3)20(14-17(16)2)22(25)15-29-23(26)21-11-7-8-12-24(21)30(27,28)19-9-5-4-6-10-19/h4-6,9-10,13-14,21H,7-8,11-12,15H2,1-3H3