(4-benzamidophenyl)-(1-oxidanylidene-1-phenoxy-pentan-2-yl)-diphenyl-phosphanium bromide

Systemtic Name: (4-benzamidophenyl)-(1-oxidanylidene-1-phenoxy-pentan-2-yl)-diphenyl-phosphanium bromide Openeye Name: (4-benzamidophenyl)-(1-phenoxycarbonylbutyl)-diphenyl-phosphonium bromide CAS Name: (4-benzamidophenyl)-(1-oxo-1-phenoxypentan-2-yl)-diphenylphosphonium bromide IUPAC Name: (4-benzamidophenyl)-(1-oxo-1-phenoxypentan-2-yl)-diphenylphosphanium bromide Traditional Name: (4-benzamidophenyl)-(1-carbophenoxybutyl)-diphenyl-phosphonium bromide Formula: C36H33BrNO3P MolecularWeight: 638.529881

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CCCC(C(=O)OC1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C36H32NO3P.BrH/c1-2-15-34(36(39)40-30-18-9-4-10-19-30)41(31-20-11-5-12-21-31,32-22-13-6-14-23-32)33-26-24-29(25-27-33)37-35(38)28-16-7-3-8-17-28;/h3-14,16-27,34H,2,15H2,1H3;1H