[1-[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]-2-oxidanylidene-pyrrolidin-3-yl]-triphenyl-phosphanium bromide

Systemtic Name: [1-[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]-2-oxidanylidene-pyrrolidin-3-yl]-triphenyl-phosphanium bromide Openeye Name: [1-(4-tert-butoxycarbonyloxyphenyl)-2-oxo-pyrrolidin-3-yl]-triphenyl-phosphonium bromide CAS Name: [1-[4-[(2-methylpropan-2-yl)oxy-oxomethoxy]phenyl]-2-oxo-3-pyrrolidinyl]-triphenylphosphonium bromide IUPAC Name: [1-[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]-2-oxopyrrolidin-3-yl]-triphenylphosphanium bromide Traditional Name: [1-(4-tert-butoxycarbonyloxyphenyl)-2-keto-pyrrolidin-3-yl]-triphenyl-phosphonium bromide Formula: C33H33BrNO4P MolecularWeight: 618.497181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC=C(C=C1)N2CCC(C2=O)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC=C(C=C1)N2CCC(C2=O)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C33H33NO4P.BrH/c1-33(2,3)38-32(36)37-26-21-19-25(20-22-26)34-24-23-30(31(34)35)39(27-13-7-4-8-14-27,28-15-9-5-10-16-28)29-17-11-6-12-18-29;/h4-22,30H,23-24H2,1-3H3;1H/q+1;/p-1