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

Systemtic Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; methyl hydrogen sulfate Openeye Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; methyl hydrogen sulfate CAS Name: 1,2-dimethyl-3,5-diphenylpyrazol-1-ium; sulfuric acid methyl ester IUPAC Name: 1,2-dimethyl-3,5-diphenylpyrazol-1-ium; methyl hydrogen sulfate Traditional Name: 1,2-dimethyl-3,5-diphenyl-pyrazol-1-ium; sulfuric acid methyl ester Formula: C18H21N2O4S+ MolecularWeight: 361.43534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.COS(=O)(=O)O

Isomeric SMILES

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.COS(=O)(=O)O

InChI

InChI=1S/C17H17N2.CH4O4S/c1-18-16(14-9-5-3-6-10-14)13-17(19(18)2)15-11-7-4-8-12-15;1-5-6(2,3)4/h3-13H,1-2H3;1H3,(H,2,3,4)/q+1;