1,2-dimethyl-4-methylsulfonyl-3,5-diphenyl-pyrazol-2-ium

Systemtic Name: 1,2-dimethyl-4-methylsulfonyl-3,5-diphenyl-pyrazol-2-ium Openeye Name: 1,2-dimethyl-4-methylsulfonyl-3,5-diphenyl-pyrazol-2-ium CAS Name: 1,2-dimethyl-4-methylsulfonyl-3,5-diphenylpyrazol-2-ium IUPAC Name: 1,2-dimethyl-4-methylsulfonyl-3,5-diphenylpyrazol-2-ium Traditional Name: 4-mesyl-1,2-dimethyl-3,5-diphenyl-pyrazol-2-ium Formula: C18H19N2O2S+ MolecularWeight: 327.42066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N2O2S/c1-19-16(14-10-6-4-7-11-14)18(23(3,21)22)17(20(19)2)15-12-8-5-9-13-15/h4-13H,1-3H3/q+1