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

Systemtic Name: [5-[(E)-3-(furan-2-yl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]methyl-triphenyl-phosphanium bromide Openeye Name: [5-[(E)-3-(2-furyl)-3-oxo-prop-1-enyl]-2-furyl]methyl-triphenyl-phosphonium bromide CAS Name: [5-[(E)-3-(2-furanyl)-3-oxoprop-1-enyl]-2-furanyl]methyl-triphenylphosphonium bromide IUPAC Name: [5-[(E)-3-(furan-2-yl)-3-oxoprop-1-enyl]furan-2-yl]methyl-triphenylphosphanium bromide Traditional Name: [5-[(E)-3-(2-furyl)-3-keto-prop-1-enyl]-2-furyl]methyl-triphenyl-phosphonium bromide Formula: C30H24BrO3P MolecularWeight: 543.387521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=C(O2)C=CC(=O)C3=CC=CO3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=C(O2)/C=C/C(=O)C3=CC=CO3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C30H24O3P.BrH/c31-29(30-17-10-22-32-30)21-20-24-18-19-25(33-24)23-34(26-11-4-1-5-12-26,27-13-6-2-7-14-27)28-15-8-3-9-16-28;/h1-22H,23H2;1H/q+1;/p-1/b21-20+;