1-(4-bromophenyl)sulfonyl-N-[[3-(dimethylaminomethyl)phenyl]methyl]piperidine-2-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[[3-(dimethylaminomethyl)phenyl]methyl]piperidine-2-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[[3-(dimethylaminomethyl)phenyl]methyl]piperidine-2-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[[3-(dimethylaminomethyl)phenyl]methyl]-2-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[[3-(dimethylaminomethyl)phenyl]methyl]piperidine-2-carboxamide Traditional Name: 1-brosyl-N-[3-(dimethylaminomethyl)benzyl]pipecolinamide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC(=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CC1=CC=CC(=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H28BrN3O3S/c1-25(2)16-18-7-5-6-17(14-18)15-24-22(27)21-8-3-4-13-26(21)30(28,29)20-11-9-19(23)10-12-20/h5-7,9-12,14,21H,3-4,8,13,15-16H2,1-2H3,(H,24,27)