(5-methoxycarbonylfuran-2-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (5-methoxycarbonylfuran-2-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (5-methoxycarbonyl-2-furyl)methyl-triphenyl-phosphonium bromide CAS Name: (5-methoxycarbonyl-2-furanyl)methyl-triphenylphosphonium bromide IUPAC Name: (5-methoxycarbonylfuran-2-yl)methyl-triphenylphosphanium bromide Traditional Name: (5-carbomethoxy-2-furyl)methyl-triphenyl-phosphonium bromide Formula: C25H22BrO3P MolecularWeight: 481.318141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC(=O)C1=CC=C(O1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C25H22O3P.BrH/c1-27-25(26)24-18-17-20(28-24)19-29(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23;/h2-18H,19H2,1H3;1H/q+1;/p-1