(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-triphenyl-phosphanium

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-triphenyl-phosphanium Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-triphenyl-phosphonium CAS Name: (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-triphenylphosphonium IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)-triphenylphosphanium Traditional Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-triphenyl-phosphonium Formula: C28H23ClN2P+ MolecularWeight: 453.922381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H23ClN2P/c1-22-27(28(29)31(30-22)23-14-6-2-7-15-23)32(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,1H3/q+1