(3,5-dimethoxyphenyl)methyl-triphenyl-phosphanium chloride

Systemtic Name: (3,5-dimethoxyphenyl)methyl-triphenyl-phosphanium chloride Openeye Name: (3,5-dimethoxyphenyl)methyl-triphenyl-phosphonium chloride CAS Name: (3,5-dimethoxyphenyl)methyl-triphenylphosphonium chloride IUPAC Name: (3,5-dimethoxyphenyl)methyl-triphenylphosphanium chloride Traditional Name: (3,5-dimethoxybenzyl)-triphenyl-phosphonium chloride Formula: C27H26ClO2P MolecularWeight: 448.920901

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Cl-]

Isomeric SMILES

COC1=CC(=CC(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Cl-]

InChI

InChI=1S/C27H26O2P.ClH/c1-28-23-18-22(19-24(20-23)29-2)21-30(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27;/h3-20H,21H2,1-2H3;1H/q+1;/p-1