1-methyl-2,3,5-triphenyl-pyrazol-1-ium iodide

Systemtic Name: 1-methyl-2,3,5-triphenyl-pyrazol-1-ium iodide Openeye Name: 1-methyl-2,3,5-triphenyl-pyrazol-1-ium iodide CAS Name: 1-methyl-2,3,5-triphenylpyrazol-1-ium iodide IUPAC Name: 1-methyl-2,3,5-triphenylpyrazol-1-ium iodide Traditional Name: 1-methyl-2,3,5-triphenyl-pyrazol-1-ium iodide Formula: C22H19IN2 MolecularWeight: 438.30413

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

C[N+]1=C(C=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C22H19N2.HI/c1-23-21(18-11-5-2-6-12-18)17-22(19-13-7-3-8-14-19)24(23)20-15-9-4-10-16-20;/h2-17H,1H3;1H/q+1;/p-1