[(2R)-2-benzamido-3-oxidanyl-3-oxidanylidene-propyl]-triphenyl-phosphanium bromide

Systemtic Name: [(2R)-2-benzamido-3-oxidanyl-3-oxidanylidene-propyl]-triphenyl-phosphanium bromide Openeye Name: [(2R)-2-benzamido-3-hydroxy-3-oxo-propyl]-triphenyl-phosphonium bromide CAS Name: [(2R)-2-benzamido-3-hydroxy-3-oxopropyl]-triphenylphosphonium bromide IUPAC Name: [(2R)-2-benzamido-3-hydroxy-3-oxopropyl]-triphenylphosphanium bromide Traditional Name: [(2R)-2-benzamido-3-hydroxy-3-keto-propyl]-triphenyl-phosphonium bromide Formula: C28H25BrNO3P MolecularWeight: 534.380761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24NO3P.BrH/c30-27(22-13-5-1-6-14-22)29-26(28(31)32)21-33(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20,26H,21H2,(H-,29,30,31,32);1H/t26-;/m0./s1