N-(4-methylphenyl)-1-methylsulfonyl-N-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: N-(4-methylphenyl)-1-methylsulfonyl-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-benzyl-1-methylsulfonyl-N-(p-tolyl)piperidine-3-carboxamide CAS Name: N-(4-methylphenyl)-1-methylsulfonyl-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-benzyl-N-(4-methylphenyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-benzyl-1-mesyl-N-(p-tolyl)nipecotamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O3S/c1-17-10-12-20(13-11-17)23(15-18-7-4-3-5-8-18)21(24)19-9-6-14-22(16-19)27(2,25)26/h3-5,7-8,10-13,19H,6,9,14-16H2,1-2H3