(3,3-dimethyl-4-oxidanylidene-butyl) 2-diphenylphosphanylbenzoate

Systemtic Name: (3,3-dimethyl-4-oxidanylidene-butyl) 2-diphenylphosphanylbenzoate Openeye Name: (3,3-dimethyl-4-oxo-butyl) 2-diphenylphosphanylbenzoate CAS Name: 2-diphenylphosphinobenzoic acid (3,3-dimethyl-4-oxobutyl) ester IUPAC Name: (3,3-dimethyl-4-oxobutyl) 2-diphenylphosphanylbenzoate Traditional Name: 2-diphenylphosphinobenzoic acid (4-keto-3,3-dimethyl-butyl) ester Formula: C25H25O3P MolecularWeight: 404.437961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25O3P/c1-25(2,19-26)17-18-28-24(27)22-15-9-10-16-23(22)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-16,19H,17-18H2,1-2H3