[3-[[[(2R)-1-(4-bromophenyl)sulfonylpiperidin-2-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [3-[[[(2R)-1-(4-bromophenyl)sulfonylpiperidin-2-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [3-[[[(2R)-1-(4-bromophenyl)sulfonylpiperidine-2-carbonyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [3-[[[[(2R)-1-(4-bromophenyl)sulfonyl-2-piperidinyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [3-[[[(2R)-1-(4-bromophenyl)sulfonylpiperidine-2-carbonyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [3-[[[(2R)-1-brosylpipecoloyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C22H29BrN3O3S+ MolecularWeight: 495.45296

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC(=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+](C)CC1=CC=CC(=C1)CNC(=O)[C@H]2CCCCN2S(=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)/p+1/t21-/m1/s1