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

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[2-[methyl(phenyl)amino]ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[2-(N-methylanilino)ethyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[2-(N-methylanilino)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[2-(N-methylanilino)ethyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-[2-(N-methylanilino)ethyl]nipecotamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CN(CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3S/c1-24(19-7-3-2-4-8-19)15-13-23-21(26)17-6-5-14-25(16-17)29(27,28)20-11-9-18(22)10-12-20/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,26)