[cyano(phenyl)methyl]-triphenyl-phosphanium bromide

Systemtic Name: [cyano(phenyl)methyl]-triphenyl-phosphanium bromide Openeye Name: [cyano(phenyl)methyl]-triphenyl-phosphonium bromide CAS Name: [cyano(phenyl)methyl]-triphenylphosphonium bromide IUPAC Name: [cyano(phenyl)methyl]-triphenylphosphanium bromide Traditional Name: [cyano(phenyl)methyl]-triphenyl-phosphonium bromide Formula: C26H21BrNP MolecularWeight: 458.329401

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C26H21NP.BrH/c27-21-26(22-13-5-1-6-14-22)28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20,26H;1H/q+1;/p-1