(2-oxidanylidene-1-phenyl-pyrrolidin-3-yl)-triphenyl-phosphanium bromide

Systemtic Name: (2-oxidanylidene-1-phenyl-pyrrolidin-3-yl)-triphenyl-phosphanium bromide Openeye Name: (2-oxo-1-phenyl-pyrrolidin-3-yl)-triphenyl-phosphonium bromide CAS Name: (2-oxo-1-phenyl-3-pyrrolidinyl)-triphenylphosphonium bromide IUPAC Name: (2-oxo-1-phenylpyrrolidin-3-yl)-triphenylphosphanium bromide Traditional Name: (2-keto-1-phenyl-pyrrolidin-3-yl)-triphenyl-phosphonium bromide Formula: C28H25BrNOP MolecularWeight: 502.381961

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1CN(C(=O)C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H25NOP.BrH/c30-28-27(21-22-29(28)23-13-5-1-6-14-23)31(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h1-20,27H,21-22H2;1H/q+1;/p-1