[1-ethoxy-2,5-dimethyl-1,6-bis(oxidanylidene)hexan-3-yl] 2-diphenylphosphanylbenzoate

Systemtic Name: [1-ethoxy-2,5-dimethyl-1,6-bis(oxidanylidene)hexan-3-yl] 2-diphenylphosphanylbenzoate Openeye Name: [1-(2-ethoxy-1-methyl-2-oxo-ethyl)-3-methyl-4-oxo-butyl] 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid (1-ethoxy-2,5-dimethyl-1,6-dioxohexan-3-yl) ester IUPAC Name: (1-ethoxy-2,5-dimethyl-1,6-dioxohexan-3-yl) 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid [1-(2-ethoxy-2-keto-1-methyl-ethyl)-4-keto-3-methyl-butyl] ester Formula: C29H31O5P MolecularWeight: 490.527201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31O5P/c1-4-33-28(31)22(3)26(19-21(2)20-30)34-29(32)25-17-11-12-18-27(25)35(23-13-7-5-8-14-23)24-15-9-6-10-16-24/h5-18,20-22,26H,4,19H2,1-3H3