[4-(dibutylamino)phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-(dibutylamino)phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-(dibutylamino)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-(dibutylamino)phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-(dibutylamino)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-(dibutylamino)benzyl]-triphenyl-phosphonium bromide Formula: C33H39BrNP MolecularWeight: 560.547221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H39NP.BrH/c1-3-5-26-34(27-6-4-2)30-24-22-29(23-25-30)28-35(31-16-10-7-11-17-31,32-18-12-8-13-19-32)33-20-14-9-15-21-33;/h7-25H,3-6,26-28H2,1-2H3;1H/q+1;/p-1