4-(methoxymethyl)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperidin-1-ium

Systemtic Name: 4-(methoxymethyl)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperidin-1-ium Openeye Name: 1-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]-4-(methoxymethyl)piperidin-1-ium CAS Name: 4-(methoxymethyl)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]piperidin-1-ium IUPAC Name: 4-(methoxymethyl)-1-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]piperidin-1-ium Traditional Name: 1-[(3-isobutyl-2-mesyl-imidazol-4-yl)methyl]-4-(methoxymethyl)piperidin-1-ium Formula: C16H30N3O3S+ MolecularWeight: 344.4927

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCC(CC2)COC

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCC(CC2)COC

InChI

InChI=1S/C16H29N3O3S/c1-13(2)10-19-15(9-17-16(19)23(4,20)21)11-18-7-5-14(6-8-18)12-22-3/h9,13-14H,5-8,10-12H2,1-4H3/p+1