N-[(4-dimethylaminophenyl)methyl]-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(4-dimethylaminophenyl)methyl]piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(4-dimethylaminophenyl)methyl]-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(4-dimethylaminophenyl)methyl]piperidine-2-carboxamide Traditional Name: 1-besyl-N-[4-(dimethylamino)benzyl]pipecolinamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-23(2)18-13-11-17(12-14-18)16-22-21(25)20-10-6-7-15-24(20)28(26,27)19-8-4-3-5-9-19/h3-5,8-9,11-14,20H,6-7,10,15-16H2,1-2H3,(H,22,25)