3-bromanyl-N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-bromo-N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-methoxy-benzenesulfonamide CAS Name: 3-bromo-N-[3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-bromo-N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-methoxybenzenesulfonamide Traditional Name: 3-bromo-N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-methoxy-benzenesulfonamide Formula: C17H28BrN2O3S+ MolecularWeight: 420.38482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCNS(=O)(=O)C2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCCNS(=O)(=O)C2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C17H27BrN2O3S/c1-13-9-14(2)12-20(11-13)8-4-7-19-24(21,22)15-5-6-17(23-3)16(18)10-15/h5-6,10,13-14,19H,4,7-9,11-12H2,1-3H3/p+1/t13-,14-/m1/s1