[4,7-bis(chloranyl)-1,3-benzoxazol-2-yl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [4,7-bis(chloranyl)-1,3-benzoxazol-2-yl]methyl-triphenyl-phosphanium chloride Openeye Name: (4,7-dichloro-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphonium chloride CAS Name: (4,7-dichloro-1,3-benzoxazol-2-yl)methyl-triphenylphosphonium chloride IUPAC Name: (4,7-dichloro-1,3-benzoxazol-2-yl)methyl-triphenylphosphanium chloride Traditional Name: (4,7-dichloro-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphonium chloride Formula: C26H19Cl3NOP MolecularWeight: 498.767921

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=NC3=C(C=CC(=C3O2)Cl)Cl)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=NC3=C(C=CC(=C3O2)Cl)Cl)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C26H19Cl2NOP.ClH/c27-22-16-17-23(28)26-25(22)29-24(30-26)18-31(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21;/h1-17H,18H2;1H/q+1;/p-1