[4-[(4-ethoxycarbonylphenyl)diazenyl]phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-[(4-ethoxycarbonylphenyl)diazenyl]phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-(4-ethoxycarbonylphenyl)azophenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-(4-ethoxycarbonylphenyl)azophenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-[(4-ethoxycarbonylphenyl)diazenyl]phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-(4-carbethoxyphenyl)azobenzyl]-triphenyl-phosphonium bromide Formula: C34H30BrN2O2P MolecularWeight: 609.491961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C34H30N2O2P.BrH/c1-2-38-34(37)28-20-24-30(25-21-28)36-35-29-22-18-27(19-23-29)26-39(31-12-6-3-7-13-31,32-14-8-4-9-15-32)33-16-10-5-11-17-33;/h3-25H,2,26H2,1H3;1H/q+1;/p-1