(3-methylphenyl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (3-methylphenyl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: m-tolylmethyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (3-methylbenzyl) ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S/c1-16-8-7-9-17(14-16)15-25-20(22)19-12-5-6-13-21(19)26(23,24)18-10-3-2-4-11-18/h2-4,7-11,14,19H,5-6,12-13,15H2,1H3