[2-bromanyl-1-ethoxy-5,5-dimethyl-7-oxidanyl-1,3,7-tris(oxidanylidene)heptan-2-yl]-triphenyl-phosphanium

Systemtic Name: [2-bromanyl-1-ethoxy-5,5-dimethyl-7-oxidanyl-1,3,7-tris(oxidanylidene)heptan-2-yl]-triphenyl-phosphanium Openeye Name: (1-bromo-1-ethoxycarbonyl-6-hydroxy-4,4-dimethyl-2,6-dioxo-hexyl)-triphenyl-phosphonium CAS Name: (2-bromo-1-ethoxy-7-hydroxy-5,5-dimethyl-1,3,7-trioxoheptan-2-yl)-triphenylphosphonium IUPAC Name: (2-bromo-1-ethoxy-7-hydroxy-5,5-dimethyl-1,3,7-trioxoheptan-2-yl)-triphenylphosphanium Traditional Name: (1-bromo-1-carbethoxy-6-hydroxy-2,6-diketo-4,4-dimethyl-hexyl)-triphenyl-phosphonium Formula: C29H31BrO5P+ MolecularWeight: 570.431201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)CC(C)(C)CC(=O)O)([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CCOC(=O)C(C(=O)CC(C)(C)CC(=O)O)([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C29H30BrO5P/c1-4-35-27(34)29(30,25(31)20-28(2,3)21-26(32)33)36(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19H,4,20-21H2,1-3H3/p+1