N-[[3-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[3-(methylcarbamoyl)benzyl]isonipecotamide Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H23N3O4S/c1-17-15(20)14-5-3-4-12(10-14)11-18-16(21)13-6-8-19(9-7-13)24(2,22)23/h3-5,10,13H,6-9,11H2,1-2H3,(H,17,20)(H,18,21)