[(3R,4S)-5-ethoxy-2,4-dimethyl-5-oxidanylidene-pent-1-en-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(3R,4S)-5-ethoxy-2,4-dimethyl-5-oxidanylidene-pent-1-en-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [(1R)-1-[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl]-2-methyl-allyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(3R,4S)-5-ethoxy-2,4-dimethyl-5-oxopent-1-en-3-yl] ester IUPAC Name: [(3R,4S)-5-ethoxy-2,4-dimethyl-5-oxopent-1-en-3-yl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(1R)-1-[(1S)-2-ethoxy-2-keto-1-methyl-ethyl]-2-methyl-allyl] ester Formula: C28H29O4P MolecularWeight: 460.501221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29O4P/c1-5-31-27(29)21(4)26(20(2)3)32-28(30)24-18-12-13-19-25(24)33(22-14-8-6-9-15-22)23-16-10-7-11-17-23/h6-19,21,26H,2,5H2,1,3-4H3/t21-,26-/m0/s1