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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H28BrN3O3S/c1-25(2)15-18-7-4-3-6-17(18)14-24-22(27)19-8-5-13-26(16-19)30(28,29)21-11-9-20(23)10-12-21/h3-4,6-7,9-12,19H,5,8,13-16H2,1-2H3,(H,24,27)