[5-ethoxy-3,5-bis(oxidanylidene)-4-triphenylphosphaniumyl-pentyl]azanium dibromide

Systemtic Name: [5-ethoxy-3,5-bis(oxidanylidene)-4-triphenylphosphaniumyl-pentyl]azanium dibromide Openeye Name: (5-ethoxy-3,5-dioxo-4-triphenylphosphaniumyl-pentyl)ammonium dibromide CAS Name: (5-ethoxy-3,5-dioxo-4-triphenylphosphiniumylpentyl)ammonium dibromide IUPAC Name: (5-ethoxy-3,5-dioxo-4-triphenylphosphaniumylpentyl)azanium dibromide Traditional Name: (5-ethoxy-3,5-diketo-4-triphenylphosphiniumyl-pentyl)ammonium dibromide Formula: C25H28Br2NO3P MolecularWeight: 581.276481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)CC[NH3+])[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-].[Br-]

Isomeric SMILES

CCOC(=O)C(C(=O)CC[NH3+])[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-].[Br-]

InChI

InChI=1S/C25H27NO3P.2BrH/c1-2-29-25(28)24(23(27)18-19-26)30(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22;;/h3-17,24H,2,18-19,26H2,1H3;2*1H/q+1;;/p-1