[4-(methylcarbamoyl)phenyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [4-(methylcarbamoyl)phenyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [4-(methylcarbamoyl)phenyl] 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid [4-(methylcarbamoyl)phenyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C21H24N2O5S/c1-15-3-9-19(10-4-15)29(26,27)23-13-11-17(12-14-23)21(25)28-18-7-5-16(6-8-18)20(24)22-2/h3-10,17H,11-14H2,1-2H3,(H,22,24)