1-(4-bromophenyl)sulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[(3-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide Traditional Name: 1-brosyl-N-(3-fluorobenzyl)-N-methyl-nipecotamide Formula: C20H22BrFN2O3S MolecularWeight: 469.367683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrFN2O3S/c1-23(13-15-4-2-6-18(22)12-15)20(25)16-5-3-11-24(14-16)28(26,27)19-9-7-17(21)8-10-19/h2,4,6-10,12,16H,3,5,11,13-14H2,1H3