5-(4-fluorophenyl)-1-methyl-1-(4-methylphenyl)sulfonyl-2-propyl-4-pyrrolidin-2-yl-imidazol-1-ium

Systemtic Name: 5-(4-fluorophenyl)-1-methyl-1-(4-methylphenyl)sulfonyl-2-propyl-4-pyrrolidin-2-yl-imidazol-1-ium Openeye Name: 5-(4-fluorophenyl)-1-methyl-2-propyl-1-(p-tolylsulfonyl)-4-pyrrolidin-2-yl-imidazol-1-ium CAS Name: 5-(4-fluorophenyl)-1-methyl-1-(4-methylphenyl)sulfonyl-2-propyl-4-(2-pyrrolidinyl)imidazol-1-ium IUPAC Name: 5-(4-fluorophenyl)-1-methyl-1-(4-methylphenyl)sulfonyl-2-propyl-4-pyrrolidin-2-ylimidazol-1-ium Traditional Name: 5-(4-fluorophenyl)-1-methyl-2-propyl-4-pyrrolidin-2-yl-1-tosyl-imidazol-1-ium Formula: C24H29FN3O2S+ MolecularWeight: 442.569363

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C([N+]1(C)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F)C4CCCN4

Isomeric SMILES

CCCC1=NC(=C([N+]1(C)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F)C4CCCN4

InChI

InChI=1S/C24H29FN3O2S/c1-4-6-22-27-23(21-7-5-16-26-21)24(18-10-12-19(25)13-11-18)28(22,3)31(29,30)20-14-8-17(2)9-15-20/h8-15,21,26H,4-7,16H2,1-3H3/q+1