[3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium

Systemtic Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Openeye Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [3-butyl-2-(4-methylpentylsulfonyl)-4-imidazolyl]methyl-methyl-(4-oxanyl)ammonium IUPAC Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Traditional Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-methyl-tetrahydropyran-4-yl-ammonium 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+](C)C2CCOCC2

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CCCC(C)C)C[NH+](C)C2CCOCC2

InChI

InChI=1S/C20H37N3O3S/c1-5-6-11-23-19(16-22(4)18-9-12-26-13-10-18)15-21-20(23)27(24,25)14-7-8-17(2)3/h15,17-18H,5-14,16H2,1-4H3/p+1