[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenyl-phosphanium chloride Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenyl-phosphonium chloride CAS Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenylphosphonium chloride IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenylphosphanium chloride Traditional Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-triphenyl-phosphonium chloride Formula: C27H21Cl2N2OP MolecularWeight: 491.348201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=NC(=NO2)C3=CC=C(C=C3)Cl)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=NC(=NO2)C3=CC=C(C=C3)Cl)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C27H21ClN2OP.ClH/c28-22-18-16-21(17-19-22)27-29-26(31-30-27)20-32(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-19H,20H2;1H/q+1;/p-1