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

Systemtic Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-(2-methoxyethyl)-propan-2-yl-azanium Openeye Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-isopropyl-(2-methoxyethyl)ammonium CAS Name: [3-butyl-2-(4-methylpentylsulfonyl)-4-imidazolyl]methyl-(2-methoxyethyl)-propan-2-ylammonium IUPAC Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-(2-methoxyethyl)-propan-2-ylazanium Traditional Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-isopropyl-(2-methoxyethyl)ammonium Formula: C20H40N3O3S+ MolecularWeight: 402.6149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H39N3O3S/c1-7-8-11-23-19(16-22(18(4)5)12-13-26-6)15-21-20(23)27(24,25)14-9-10-17(2)3/h15,17-18H,7-14,16H2,1-6H3/p+1