[(E,2S,3S,4R)-1-(2,2-dimethylpropanoyloxy)-8-ethoxy-2,4-dimethyl-8-oxidanylidene-oct-6-en-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(E,2S,3S,4R)-1-(2,2-dimethylpropanoyloxy)-8-ethoxy-2,4-dimethyl-8-oxidanylidene-oct-6-en-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [(E,1S,2R)-1-[(1S)-2-(2,2-dimethylpropanoyloxy)-1-methyl-ethyl]-6-ethoxy-2-methyl-6-oxo-hex-4-enyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(E,2S,3S,4R)-1-(2,2-dimethyl-1-oxopropoxy)-8-ethoxy-2,4-dimethyl-8-oxooct-6-en-3-yl] ester IUPAC Name: [(E,2S,3S,4R)-1-(2,2-dimethylpropanoyloxy)-8-ethoxy-2,4-dimethyl-8-oxooct-6-en-3-yl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(E,1S,2R)-6-ethoxy-6-keto-2-methyl-1-[(1S)-1-methyl-2-pivaloyloxy-ethyl]hex-4-enyl] ester Formula: C36H43O6P MolecularWeight: 602.696781

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC(C)C(C(C)COC(=O)C(C)(C)C)OC(=O)C1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C[C@@H](C)[C@@H]([C@@H](C)COC(=O)C(C)(C)C)OC(=O)C1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C36H43O6P/c1-7-40-32(37)24-16-17-26(2)33(27(3)25-41-35(39)36(4,5)6)42-34(38)30-22-14-15-23-31(30)43(28-18-10-8-11-19-28)29-20-12-9-13-21-29/h8-16,18-24,26-27,33H,7,17,25H2,1-6H3/b24-16+/t26-,27+,33+/m1/s1