(6-chloranyl-2-phenyl-pyrimidin-4-yl)-triphenyl-phosphanium chloride

Systemtic Name: (6-chloranyl-2-phenyl-pyrimidin-4-yl)-triphenyl-phosphanium chloride Openeye Name: (6-chloro-2-phenyl-pyrimidin-4-yl)-triphenyl-phosphonium chloride CAS Name: (6-chloro-2-phenyl-4-pyrimidinyl)-triphenylphosphonium chloride IUPAC Name: (6-chloro-2-phenylpyrimidin-4-yl)-triphenylphosphanium chloride Traditional Name: (6-chloro-2-phenyl-pyrimidin-4-yl)-triphenyl-phosphonium chloride Formula: C28H21Cl2N2P MolecularWeight: 487.359501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC(=N2)Cl)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC(=N2)Cl)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C28H21ClN2P.ClH/c29-26-21-27(31-28(30-26)22-13-5-1-6-14-22)32(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-21H;1H/q+1;/p-1