(3-methoxy-4-methyl-5-oxidanylidene-2H-furan-2-yl)-triphenyl-phosphanium bromide

Systemtic Name: (3-methoxy-4-methyl-5-oxidanylidene-2H-furan-2-yl)-triphenyl-phosphanium bromide Openeye Name: (3-methoxy-4-methyl-5-oxo-2H-furan-2-yl)-triphenyl-phosphonium bromide CAS Name: (3-methoxy-4-methyl-5-oxo-2H-furan-2-yl)-triphenylphosphonium bromide IUPAC Name: (3-methoxy-4-methyl-5-oxo-2H-furan-2-yl)-triphenylphosphanium bromide Traditional Name: (5-keto-3-methoxy-4-methyl-2H-furan-2-yl)-triphenyl-phosphonium bromide Formula: C24H22BrO3P MolecularWeight: 469.307441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(OC1=O)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Br-]

Isomeric SMILES

CC1=C(C(OC1=O)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Br-]

InChI

InChI=1S/C24H22O3P.BrH/c1-18-22(26-2)24(27-23(18)25)28(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-17,24H,1-2H3;1H/q+1;/p-1