3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(4-fluoro-3-methyl-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(4-fluoro-3-methylphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(4-fluoro-3-methylphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(4-fluoro-3-methyl-phenyl)sulfonyl-2-phenyl-2-imidazolin-1-ium Formula: C16H16FN2O2S+ MolecularWeight: 319.373843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3)F

InChI

InChI=1S/C16H15FN2O2S/c1-12-11-14(7-8-15(12)17)22(20,21)19-10-9-18-16(19)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3/p+1