(3-ethoxycarbonyl-2-propyl-phenyl)-diphenyl-phosphanium bromide

Systemtic Name: (3-ethoxycarbonyl-2-propyl-phenyl)-diphenyl-phosphanium bromide Openeye Name: (3-ethoxycarbonyl-2-propyl-phenyl)-diphenyl-phosphonium bromide CAS Name: (3-ethoxycarbonyl-2-propylphenyl)-diphenylphosphonium bromide IUPAC Name: (3-ethoxycarbonyl-2-propylphenyl)-diphenylphosphanium bromide Traditional Name: (3-carbethoxy-2-propyl-phenyl)-diphenyl-phosphonium bromide Formula: C24H26BrO2P MolecularWeight: 457.339801

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC.[Br-]

Isomeric SMILES

CCCC1=C(C=CC=C1[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC.[Br-]

InChI

InChI=1S/C24H25O2P.BrH/c1-3-12-21-22(24(25)26-4-2)17-11-18-23(21)27(19-13-7-5-8-14-19)20-15-9-6-10-16-20;/h5-11,13-18H,3-4,12H2,1-2H3;1H