(3-methoxycarbonylphenyl)-pentyl-diphenyl-phosphanium bromide

Systemtic Name: (3-methoxycarbonylphenyl)-pentyl-diphenyl-phosphanium bromide Openeye Name: (3-methoxycarbonylphenyl)-pentyl-diphenyl-phosphonium bromide CAS Name: (3-methoxycarbonylphenyl)-pentyl-diphenylphosphonium bromide IUPAC Name: (3-methoxycarbonylphenyl)-pentyl-diphenylphosphanium bromide Traditional Name: amyl-(3-carbomethoxyphenyl)-diphenyl-phosphonium bromide Formula: C25H28BrO2P MolecularWeight: 471.366381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)OC.[Br-]

Isomeric SMILES

CCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)OC.[Br-]

InChI

InChI=1S/C25H28O2P.BrH/c1-3-4-11-19-28(22-14-7-5-8-15-22,23-16-9-6-10-17-23)24-18-12-13-21(20-24)25(26)27-2;/h5-10,12-18,20H,3-4,11,19H2,1-2H3;1H/q+1;/p-1