N-(2-methylpropyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-isobutyl-piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2-methylpropyl)-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2-methylpropyl)piperidine-3-carboxamide Traditional Name: 1-besyl-N-isobutyl-nipecotamide Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H24N2O3S/c1-13(2)11-17-16(19)14-7-6-10-18(12-14)22(20,21)15-8-4-3-5-9-15/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3,(H,17,19)