2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide

Systemtic Name: 2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide Openeye Name: 2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide CAS Name: 2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide IUPAC Name: 2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide Traditional Name: 2-methyl-5-[[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amino]benzenesulfonamide Formula: C15H24N3O2S+ MolecularWeight: 310.43496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CC3CCC(C2)[NH+]3C)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2C[C@H]3CC[C@@H](C2)[NH+]3C)S(=O)(=O)N

InChI

InChI=1S/C15H23N3O2S/c1-10-3-4-11(9-15(10)21(16,19)20)17-12-7-13-5-6-14(8-12)18(13)2/h3-4,9,12-14,17H,5-8H2,1-2H3,(H2,16,19,20)/p+1/t12?,13-,14+