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

Systemtic Name: 3-(3-ethoxy-4-fluoranyl-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(3-ethoxy-4-fluoro-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(3-ethoxy-4-fluorophenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(3-ethoxy-4-fluorophenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(3-ethoxy-4-fluoro-phenyl)sulfonyl-2-methyl-2-imidazolin-1-ium Formula: C12H16FN2O3S+ MolecularWeight: 287.330443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C)F

InChI

InChI=1S/C12H15FN2O3S/c1-3-18-12-8-10(4-5-11(12)13)19(16,17)15-7-6-14-9(15)2/h4-5,8H,3,6-7H2,1-2H3/p+1