3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenyl-phosphanium

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenyl-phosphanium Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenyl-phosphonium CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenylphosphonium IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenylphosphanium Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl-triphenyl-phosphonium Formula: C29H28O2P+ MolecularWeight: 439.505181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28O2P/c1-4-12-25(13-5-1)32(26-14-6-2-7-15-26,27-16-8-3-9-17-27)22-10-11-24-18-19-28-29(23-24)31-21-20-30-28/h1-9,12-19,23H,10-11,20-22H2/q+1