triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphanium bromide

Systemtic Name: triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphanium bromide Openeye Name: triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphonium bromide CAS Name: triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphonium bromide IUPAC Name: triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphanium bromide Traditional Name: triphenyl-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]phosphonium bromide Formula: C27H32BrO2P MolecularWeight: 499.419541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(C)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1(COC(OC1)(C)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C27H32O2P.BrH/c1-26(2)21-28-27(3,29-22-26)19-20-30(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25;/h4-18H,19-22H2,1-3H3;1H/q+1;/p-1