3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium; hydrogen sulfate

Systemtic Name: 3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium; hydrogen sulfate Openeye Name: 3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium; hydrogen sulfate CAS Name: 3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium; hydrogen sulfate IUPAC Name: 3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium; hydrogen sulfate Traditional Name: 3-(3-fluorophenyl)-1,4-dimethyl-1,2,4-triazol-4-ium bisulfate Formula: C10H12FN3O4S MolecularWeight: 289.283383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C(=N1)C2=CC(=CC=C2)F)C.OS(=O)(=O)[O-]

Isomeric SMILES

CN1C=[N+](C(=N1)C2=CC(=CC=C2)F)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C10H11FN3.H2O4S/c1-13-7-14(2)12-10(13)8-4-3-5-9(11)6-8;1-5(2,3)4/h3-7H,1-2H3;(H2,1,2,3,4)/q+1;/p-1