[2-chloranyl-4-(trifluoromethyl)phenyl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [2-chloranyl-4-(trifluoromethyl)phenyl]methyl-triphenyl-phosphanium chloride Openeye Name: [2-chloro-4-(trifluoromethyl)phenyl]methyl-triphenyl-phosphonium chloride CAS Name: [2-chloro-4-(trifluoromethyl)phenyl]methyl-triphenylphosphonium chloride IUPAC Name: [2-chloro-4-(trifluoromethyl)phenyl]methyl-triphenylphosphanium chloride Traditional Name: [2-chloro-4-(trifluoromethyl)benzyl]-triphenyl-phosphonium chloride Formula: C26H20Cl2F3P MolecularWeight: 491.311971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=C(C=C(C=C2)C(F)(F)F)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=C(C=C(C=C2)C(F)(F)F)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C26H20ClF3P.ClH/c27-25-18-21(26(28,29)30)17-16-20(25)19-31(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24;/h1-18H,19H2;1H/q+1;/p-1