[(3R)-1-[[3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-[[3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-[(3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-[[3-butyl-2-(4-methylpentylsulfonyl)-4-imidazolyl]methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-[[3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-[(3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methanol Formula: C20H38N3O3S+ MolecularWeight: 400.59902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CCCC(C)C)C[NH+]2CCCC(C2)CO

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CCCC(C)C)C[NH+]2CCC[C@H](C2)CO

InChI

InChI=1S/C20H37N3O3S/c1-4-5-11-23-19(15-22-10-6-9-18(14-22)16-24)13-21-20(23)27(25,26)12-7-8-17(2)3/h13,17-18,24H,4-12,14-16H2,1-3H3/p+1/t18-/m1/s1