2,3-dihydrophthalazin-6-ylcarbonyl(triphenyl)phosphanium bromide

Systemtic Name: 2,3-dihydrophthalazin-6-ylcarbonyl(triphenyl)phosphanium bromide Openeye Name: 2,3-dihydrophthalazine-6-carbonyl(triphenyl)phosphonium bromide CAS Name: [2,3-dihydrophthalazin-6-yl(oxo)methyl]-triphenylphosphonium bromide IUPAC Name: 2,3-dihydrophthalazine-6-carbonyl(triphenyl)phosphanium bromide Traditional Name: 2,3-dihydrophthalazine-6-carbonyl(triphenyl)phosphonium bromide Formula: C27H22BrN2OP MolecularWeight: 501.354141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)C4=CC5=CNNC=C5C=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)C4=CC5=CNNC=C5C=C4.[Br-]

InChI

InChI=1S/C27H21N2OP.BrH/c30-27(21-16-17-22-19-28-29-20-23(22)18-21)31(24-10-4-1-5-11-24,25-12-6-2-7-13-25)26-14-8-3-9-15-26;/h1-20,28H;1H