[2-oxidanylidene-2-[(E)-8-oxidanylidene-8-(6-oxidanylidenehexan-2-yloxy)oct-6-en-2-yl]oxy-ethyl]-triphenyl-phosphanium bromide

Systemtic Name: [2-oxidanylidene-2-[(E)-8-oxidanylidene-8-(6-oxidanylidenehexan-2-yloxy)oct-6-en-2-yl]oxy-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-[(E)-1-methyl-7-(1-methyl-5-oxo-pentoxy)-7-oxo-hept-5-enoxy]-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-oxo-2-[(E)-8-oxo-8-(6-oxohexan-2-yloxy)oct-6-en-2-yl]oxyethyl]-triphenylphosphonium bromide IUPAC Name: [2-oxo-2-[(E)-8-oxo-8-(6-oxohexan-2-yloxy)oct-6-en-2-yl]oxyethyl]-triphenylphosphanium bromide Traditional Name: [2-keto-2-[(E)-7-keto-7-(5-keto-1-methyl-pentoxy)-1-methyl-hept-5-enoxy]ethyl]-triphenyl-phosphonium bromide Formula: C34H40BrO5P MolecularWeight: 639.556161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H40O5P.BrH/c1-28(18-15-16-26-35)38-33(36)25-14-3-7-17-29(2)39-34(37)27-40(30-19-8-4-9-20-30,31-21-10-5-11-22-31)32-23-12-6-13-24-32;/h4-6,8-14,19-26,28-29H,3,7,15-18,27H2,1-2H3;1H/q+1;/p-1/b25-14+;