[(2Z,4E)-3-fluoranyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenyl-phosphanium bromide

Systemtic Name: [(2Z,4E)-3-fluoranyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenyl-phosphanium bromide Openeye Name: [(2Z,4E)-3-fluoro-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenyl-phosphonium bromide CAS Name: [(2Z,4E)-3-fluoro-5-(2,6,6-trimethyl-1-cyclohexenyl)penta-2,4-dienyl]-triphenylphosphonium bromide IUPAC Name: [(2Z,4E)-3-fluoro-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenylphosphanium bromide Traditional Name: [(2Z,4E)-3-fluoro-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenyl-phosphonium bromide Formula: C32H35BrFP MolecularWeight: 549.496464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)F.[Br-]

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/F.[Br-]

InChI

InChI=1S/C32H35FP.BrH/c1-26-14-13-24-32(2,3)31(26)22-21-27(33)23-25-34(28-15-7-4-8-16-28,29-17-9-5-10-18-29)30-19-11-6-12-20-30;/h4-12,15-23H,13-14,24-25H2,1-3H3;1H/q+1;/p-1/b22-21+,27-23-;