[(1S,3S)-1-cyclohexyl-3-methyl-5-oxidanylidene-pentyl] 2-diphenylphosphanylbenzoate

Systemtic Name: [(1S,3S)-1-cyclohexyl-3-methyl-5-oxidanylidene-pentyl] 2-diphenylphosphanylbenzoate Openeye Name: [(1S,3S)-1-cyclohexyl-3-methyl-5-oxo-pentyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid [(1S,3S)-1-cyclohexyl-3-methyl-5-oxopentyl] ester IUPAC Name: [(1S,3S)-1-cyclohexyl-3-methyl-5-oxopentyl] 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [(1S,3S)-1-cyclohexyl-5-keto-3-methyl-pentyl] ester Formula: C31H35O3P MolecularWeight: 486.581561

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)CC(C1CCCCC1)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CC=O)C[C@@H](C1CCCCC1)OC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H35O3P/c1-24(21-22-32)23-29(25-13-5-2-6-14-25)34-31(33)28-19-11-12-20-30(28)35(26-15-7-3-8-16-26)27-17-9-4-10-18-27/h3-4,7-12,15-20,22,24-25,29H,2,5-6,13-14,21,23H2,1H3/t24-,29+/m1/s1