[(2E,4E,6E)-3,7-dimethyl-8-oxidanylidene-nona-2,4,6-trienyl]-triphenyl-phosphanium bromide

Systemtic Name: [(2E,4E,6E)-3,7-dimethyl-8-oxidanylidene-nona-2,4,6-trienyl]-triphenyl-phosphanium bromide Openeye Name: [(2E,4E,6E)-3,7-dimethyl-8-oxo-nona-2,4,6-trienyl]-triphenyl-phosphonium bromide CAS Name: [(2E,4E,6E)-3,7-dimethyl-8-oxonona-2,4,6-trienyl]-triphenylphosphonium bromide IUPAC Name: [(2E,4E,6E)-3,7-dimethyl-8-oxonona-2,4,6-trienyl]-triphenylphosphanium bromide Traditional Name: [(2E,4E,6E)-8-keto-3,7-dimethyl-nona-2,4,6-trienyl]-triphenyl-phosphonium bromide Formula: C29H30BrOP MolecularWeight: 505.425661

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30OP.BrH/c1-24(14-13-15-25(2)26(3)30)22-23-31(27-16-7-4-8-17-27,28-18-9-5-10-19-28)29-20-11-6-12-21-29;/h4-22H,23H2,1-3H3;1H/q+1;/p-1/b14-13+,24-22+,25-15+;