(3-ethoxycarbonyl-2,2-dimethyl-cyclopropyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (3-ethoxycarbonyl-2,2-dimethyl-cyclopropyl)methyl-triphenyl-phosphanium bromide Openeye Name: (3-ethoxycarbonyl-2,2-dimethyl-cyclopropyl)methyl-triphenyl-phosphonium bromide CAS Name: (3-ethoxycarbonyl-2,2-dimethylcyclopropyl)methyl-triphenylphosphonium bromide IUPAC Name: (3-ethoxycarbonyl-2,2-dimethylcyclopropyl)methyl-triphenylphosphanium bromide Traditional Name: (3-carbethoxy-2,2-dimethyl-cyclopropyl)methyl-triphenyl-phosphonium bromide Formula: C27H30BrO2P MolecularWeight: 497.403661

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C1(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CCOC(=O)C1C(C1(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H30O2P.BrH/c1-4-29-26(28)25-24(27(25,2)3)20-30(21-14-8-5-9-15-21,22-16-10-6-11-17-22)23-18-12-7-13-19-23;/h5-19,24-25H,4,20H2,1-3H3;1H/q+1;/p-1