[diethoxyphosphorylmethyl(prop-2-enyl)amino]-triphenyl-phosphanium bromide

Systemtic Name: [diethoxyphosphorylmethyl(prop-2-enyl)amino]-triphenyl-phosphanium bromide Openeye Name: [allyl(diethoxyphosphorylmethyl)amino]-triphenyl-phosphonium bromide CAS Name: [diethoxyphosphorylmethyl(prop-2-enyl)amino]-triphenylphosphonium bromide IUPAC Name: [diethoxyphosphorylmethyl(prop-2-enyl)amino]-triphenylphosphanium bromide Traditional Name: [allyl(diethoxyphosphorylmethyl)amino]-triphenyl-phosphonium bromide Formula: C26H32BrNO3P2 MolecularWeight: 548.388702

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CN(CC=C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)OCC.[Br-]

Isomeric SMILES

CCOP(=O)(CN(CC=C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)OCC.[Br-]

InChI

InChI=1S/C26H32NO3P2.BrH/c1-4-22-27(23-31(28,29-5-2)30-6-3)32(24-16-10-7-11-17-24,25-18-12-8-13-19-25)26-20-14-9-15-21-26;/h4,7-21H,1,5-6,22-23H2,2-3H3;1H/q+1;/p-1