1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; hydron; sulfate

Systemtic Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; hydron; sulfate Openeye Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; hydron; sulfate CAS Name: 1,2-dimethyl-3,5-diphenylpyrazol-1-ium; hydron; sulfate IUPAC Name: 1,2-dimethyl-3,5-diphenylpyrazol-1-ium; hydron; sulfate Traditional Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; hydron; sulfate Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[H+].CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

Isomeric SMILES

[H+].CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C17H17N2.H2O4S/c1-18-16(14-9-5-3-6-10-14)13-17(19(18)2)15-11-7-4-8-12-15;1-5(2,3)4/h3-13H,1-2H3;(H2,1,2,3,4)/q+1;/p-1