[(2E,4E,6E)-8-ethoxy-8-oxidanylidene-octa-2,4,6-trienyl]-triphenyl-phosphanium bromide

Systemtic Name: [(2E,4E,6E)-8-ethoxy-8-oxidanylidene-octa-2,4,6-trienyl]-triphenyl-phosphanium bromide Openeye Name: [(2E,4E,6E)-8-ethoxy-8-oxo-octa-2,4,6-trienyl]-triphenyl-phosphonium bromide CAS Name: [(2E,4E,6E)-8-ethoxy-8-oxoocta-2,4,6-trienyl]-triphenylphosphonium bromide IUPAC Name: [(2E,4E,6E)-8-ethoxy-8-oxoocta-2,4,6-trienyl]-triphenylphosphanium bromide Traditional Name: [(2E,4E,6E)-8-ethoxy-8-keto-octa-2,4,6-trienyl]-triphenyl-phosphonium bromide Formula: C28H28BrO2P MolecularWeight: 507.398481

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28O2P.BrH/c1-2-30-28(29)23-15-4-3-5-16-24-31(25-17-9-6-10-18-25,26-19-11-7-12-20-26)27-21-13-8-14-22-27;/h3-23H,2,24H2,1H3;1H/q+1;/p-1/b4-3+,16-5+,23-15+;