[2-(4-ethoxy-4-oxidanylidene-2-phenyl-butyl)-1,3-oxazol-4-yl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [2-(4-ethoxy-4-oxidanylidene-2-phenyl-butyl)-1,3-oxazol-4-yl]methyl-triphenyl-phosphanium bromide Openeye Name: [2-(4-ethoxy-4-oxo-2-phenyl-butyl)oxazol-4-yl]methyl-triphenyl-phosphonium bromide CAS Name: [2-(4-ethoxy-4-oxo-2-phenylbutyl)-4-oxazolyl]methyl-triphenylphosphonium bromide IUPAC Name: [2-(4-ethoxy-4-oxo-2-phenylbutyl)-1,3-oxazol-4-yl]methyl-triphenylphosphanium bromide Traditional Name: [2-(4-ethoxy-4-keto-2-phenyl-butyl)oxazol-4-yl]methyl-triphenyl-phosphonium bromide Formula: C34H33BrNO3P MolecularWeight: 614.508481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1=NC(=CO1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CCOC(=O)CC(CC1=NC(=CO1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C34H33NO3P.BrH/c1-2-37-34(36)24-28(27-15-7-3-8-16-27)23-33-35-29(25-38-33)26-39(30-17-9-4-10-18-30,31-19-11-5-12-20-31)32-21-13-6-14-22-32;/h3-22,25,28H,2,23-24,26H2,1H3;1H/q+1;/p-1