N-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine

Systemtic Name: N-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine Openeye Name: N-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine CAS Name: N-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl]-N,1-dimethyl-4-piperidin-1-iumamine IUPAC Name: N-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-N,1-dimethylpiperidin-1-ium-4-amine Traditional Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C21H39N4O3S+ MolecularWeight: 427.62436

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CCCCC3

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CCCCC3

InChI

InChI=1S/C21H38N4O3S/c1-23-11-9-19(10-12-23)24(2)16-20-15-22-21(25(20)13-14-28-3)29(26,27)17-18-7-5-4-6-8-18/h15,18-19H,4-14,16-17H2,1-3H3/p+1