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

Systemtic Name: 3-(4-fluoranyl-3-methoxy-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(4-fluoro-3-methoxy-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(4-fluoro-3-methoxyphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(4-fluoro-3-methoxyphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(4-fluoro-3-methoxy-phenyl)sulfonyl-2-phenyl-2-imidazolin-1-ium Formula: C16H16FN2O3S+ MolecularWeight: 335.373243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3)F

InChI

InChI=1S/C16H15FN2O3S/c1-22-15-11-13(7-8-14(15)17)23(20,21)19-10-9-18-16(19)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3/p+1