(7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (7-methoxy-2,2-dimethyl-3H-benzofuran-5-yl)methyl-triphenyl-phosphonium bromide CAS Name: (7-methoxy-2,2-dimethyl-3H-benzofuran-5-yl)methyl-triphenylphosphonium bromide IUPAC Name: (7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)methyl-triphenylphosphanium bromide Traditional Name: (7-methoxy-2,2-dimethyl-coumaran-5-yl)methyl-triphenyl-phosphonium bromide Formula: C30H30BrO2P MolecularWeight: 533.435761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=CC(=C2O1)OC)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C.[Br-]

Isomeric SMILES

CC1(CC2=CC(=CC(=C2O1)OC)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C.[Br-]

InChI

InChI=1S/C30H30O2P.BrH/c1-30(2)21-24-19-23(20-28(31-3)29(24)32-30)22-33(25-13-7-4-8-14-25,26-15-9-5-10-16-26)27-17-11-6-12-18-27;/h4-20H,21-22H2,1-3H3;1H/q+1;/p-1