[3-cyclohexylcarbonyloxy-4-[1-methoxy-1,3-bis(oxidanylidene)-2-thiophen-2-yl-propan-2-yl]phenyl]-diphenyl-phosphanium bromide

Systemtic Name: [3-cyclohexylcarbonyloxy-4-[1-methoxy-1,3-bis(oxidanylidene)-2-thiophen-2-yl-propan-2-yl]phenyl]-diphenyl-phosphanium bromide Openeye Name: [3-(cyclohexanecarbonyloxy)-4-[1-formyl-2-methoxy-2-oxo-1-(2-thienyl)ethyl]phenyl]-diphenyl-phosphonium bromide CAS Name: [3-[cyclohexyl(oxo)methoxy]-4-(1-methoxy-1,3-dioxo-2-thiophen-2-ylpropan-2-yl)phenyl]-diphenylphosphonium bromide IUPAC Name: [3-(cyclohexanecarbonyloxy)-4-(1-methoxy-1,3-dioxo-2-thiophen-2-ylpropan-2-yl)phenyl]-diphenylphosphanium bromide Traditional Name: [3-(cyclohexanecarbonyloxy)-4-[1-formyl-2-keto-2-methoxy-1-(2-thienyl)ethyl]phenyl]-diphenyl-phosphonium bromide Formula: C33H32BrO5PS MolecularWeight: 651.546941

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=O)(C1=C(C=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4CCCCC4)C5=CC=CS5.[Br-]

Isomeric SMILES

COC(=O)C(C=O)(C1=C(C=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4CCCCC4)C5=CC=CS5.[Br-]

InChI

InChI=1S/C33H31O5PS.BrH/c1-37-32(36)33(23-34,30-18-11-21-40-30)28-20-19-27(22-29(28)38-31(35)24-12-5-2-6-13-24)39(25-14-7-3-8-15-25)26-16-9-4-10-17-26;/h3-4,7-11,14-24H,2,5-6,12-13H2,1H3;1H