N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]-N-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]methanamine

Systemtic Name: N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]-N-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]methanamine Openeye Name: N-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]methanamine CAS Name: N-methyl-1-[(2R)-1-methyl-2-piperidin-1-iumyl]-N-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]methanamine IUPAC Name: N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]-N-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]methanamine Traditional Name: (3-isobutyl-2-mesyl-imidazol-4-yl)methyl-methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]amine Formula: C17H33N4O2S+ MolecularWeight: 357.53452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN(C)CC2CCCC[NH+]2C

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN(C)C[C@H]2CCCC[NH+]2C

InChI

InChI=1S/C17H32N4O2S/c1-14(2)11-21-16(10-18-17(21)24(5,22)23)13-19(3)12-15-8-6-7-9-20(15)4/h10,14-15H,6-9,11-13H2,1-5H3/p+1/t15-/m1/s1