(2,3-dimethylphenyl)methyl-triphenyl-phosphanium chloride

Systemtic Name: (2,3-dimethylphenyl)methyl-triphenyl-phosphanium chloride Openeye Name: (2,3-dimethylphenyl)methyl-triphenyl-phosphonium chloride CAS Name: (2,3-dimethylphenyl)methyl-triphenylphosphonium chloride IUPAC Name: (2,3-dimethylphenyl)methyl-triphenylphosphanium chloride Traditional Name: (2,3-dimethylbenzyl)-triphenyl-phosphonium chloride Formula: C27H26ClP MolecularWeight: 416.922101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Cl-]

Isomeric SMILES

CC1=C(C(=CC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Cl-]

InChI

InChI=1S/C27H26P.ClH/c1-22-13-12-14-24(23(22)2)21-28(25-15-6-3-7-16-25,26-17-8-4-9-18-26)27-19-10-5-11-20-27;/h3-20H,21H2,1-2H3;1H/q+1;/p-1