[5-[(E)-3-(4-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [5-[(E)-3-(4-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]methyl-triphenyl-phosphanium bromide Openeye Name: [5-[(E)-3-(4-methoxyphenyl)-3-oxo-prop-1-enyl]-2-furyl]methyl-triphenyl-phosphonium bromide CAS Name: [5-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]-2-furanyl]methyl-triphenylphosphonium bromide IUPAC Name: [5-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]furan-2-yl]methyl-triphenylphosphanium bromide Traditional Name: [5-[(E)-3-keto-3-(4-methoxyphenyl)prop-1-enyl]-2-furyl]methyl-triphenyl-phosphonium bromide Formula: C33H28BrO3P MolecularWeight: 583.451381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C=CC2=CC=C(O2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(O2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C33H28O3P.BrH/c1-35-27-19-17-26(18-20-27)33(34)24-23-28-21-22-29(36-28)25-37(30-11-5-2-6-12-30,31-13-7-3-8-14-31)32-15-9-4-10-16-32;/h2-24H,25H2,1H3;1H/q+1;/p-1/b24-23+;