(3-methoxyphenyl)methyl-diphenyl-[(E)-3-phenylprop-2-enyl]phosphanium bromide

Systemtic Name: (3-methoxyphenyl)methyl-diphenyl-[(E)-3-phenylprop-2-enyl]phosphanium bromide Openeye Name: [(E)-cinnamyl]-[(3-methoxyphenyl)methyl]-diphenyl-phosphonium bromide CAS Name: (3-methoxyphenyl)methyl-diphenyl-[(E)-3-phenylprop-2-enyl]phosphonium bromide IUPAC Name: (3-methoxyphenyl)methyl-diphenyl-[(E)-3-phenylprop-2-enyl]phosphanium bromide Traditional Name: [(E)-cinnamyl]-m-anisyl-diphenyl-phosphonium bromide Formula: C29H28BrOP MolecularWeight: 503.409781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[P+](CC=CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC=CC(=C1)C[P+](C/C=C/C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C29H28OP.BrH/c1-30-27-17-11-15-26(23-27)24-31(28-18-7-3-8-19-28,29-20-9-4-10-21-29)22-12-16-25-13-5-2-6-14-25;/h2-21,23H,22,24H2,1H3;1H/q+1;/p-1/b16-12+;