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

Systemtic Name: N-[(3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]methanamine Openeye Name: N-[(3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]methanamine CAS Name: N-[(3-butyl-2-cyclohexylsulfonyl-4-imidazolyl)methyl]-N-methyl-1-[(2R)-1-methyl-2-piperidin-1-iumyl]methanamine IUPAC Name: N-[(3-butyl-2-cyclohexylsulfonylimidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpiperidin-1-ium-2-yl]methanamine Traditional Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]amine Formula: C22H41N4O2S+ MolecularWeight: 425.65154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)CN(C)CC3CCCC[NH+]3C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)CN(C)C[C@H]3CCCC[NH+]3C

InChI

InChI=1S/C22H40N4O2S/c1-4-5-15-26-20(18-24(2)17-19-11-9-10-14-25(19)3)16-23-22(26)29(27,28)21-12-7-6-8-13-21/h16,19,21H,4-15,17-18H2,1-3H3/p+1/t19-/m1/s1