4-phenylbutyl 1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl 1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 4-phenylbutyl 1-(p-tolylsulfonyl)piperidine-2-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-tosylpipecolinic acid 4-phenylbutyl ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C23H29NO4S/c1-19-13-15-21(16-14-19)29(26,27)24-17-7-5-12-22(24)23(25)28-18-8-6-11-20-9-3-2-4-10-20/h2-4,9-10,13-16,22H,5-8,11-12,17-18H2,1H3