methyl-[(4-methylphenyl)methyl]-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]azanium

Systemtic Name: methyl-[(4-methylphenyl)methyl]-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]azanium Openeye Name: (3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl-methyl-(p-tolylmethyl)ammonium CAS Name: methyl-[(4-methylphenyl)methyl]-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]ammonium IUPAC Name: methyl-[(4-methylphenyl)methyl]-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]azanium Traditional Name: (3-isobutyl-2-mesyl-imidazol-4-yl)methyl-methyl-(4-methylbenzyl)ammonium Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CC2=CN=C(N2CC(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CC2=CN=C(N2CC(C)C)S(=O)(=O)C

InChI

InChI=1S/C18H27N3O2S/c1-14(2)11-21-17(10-19-18(21)24(5,22)23)13-20(4)12-16-8-6-15(3)7-9-16/h6-10,14H,11-13H2,1-5H3/p+1