N-[(3-methylphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(3-methylphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: 1-methylsulfonyl-N-(m-tolylmethyl)piperidine-3-carboxamide CAS Name: N-[(3-methylphenyl)methyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(3-methylphenyl)methyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: 1-mesyl-N-(3-methylbenzyl)nipecotamide Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3S/c1-12-5-3-6-13(9-12)10-16-15(18)14-7-4-8-17(11-14)21(2,19)20/h3,5-6,9,14H,4,7-8,10-11H2,1-2H3,(H,16,18)