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

Systemtic Name: (3S)-N-(4-methylphenyl)-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-1-methylsulfonyl-N-(p-tolyl)piperidine-3-carboxamide CAS Name: (3S)-N-(4-methylphenyl)-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-methylphenyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-1-mesyl-N-(p-tolyl)nipecotamide Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C14H20N2O3S/c1-11-5-7-13(8-6-11)15-14(17)12-4-3-9-16(10-12)20(2,18)19/h5-8,12H,3-4,9-10H2,1-2H3,(H,15,17)/t12-/m0/s1