[(3R,4R)-2,4-dimethyl-6-oxidanylidene-hexan-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(3R,4R)-2,4-dimethyl-6-oxidanylidene-hexan-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [(1R,2R)-1-isopropyl-2-methyl-4-oxo-butyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(3R,4R)-2,4-dimethyl-6-oxohexan-3-yl] ester IUPAC Name: [(3R,4R)-2,4-dimethyl-6-oxohexan-3-yl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(1R,2R)-1-isopropyl-4-keto-2-methyl-butyl] ester Formula: C27H29O3P MolecularWeight: 432.491121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29O3P/c1-20(2)26(21(3)18-19-28)30-27(29)24-16-10-11-17-25(24)31(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-17,19-21,26H,18H2,1-3H3/t21-,26-/m1/s1