2-methylpropyl 2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-hexanoate

Systemtic Name: 2-methylpropyl 2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-hexanoate Openeye Name: isobutyl 2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanyl-hexanoate CAS Name: 2-[1,2-dioxo-2-(2,4,6-trimethylphenyl)ethyl]-2-phosphinohexanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanylhexanoate Traditional Name: 2-(2-keto-2-mesityl-acetyl)-2-phosphino-hexanoic acid isobutyl ester Formula: C21H31O4P MolecularWeight: 378.442201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)C1=C(C=C(C=C1C)C)C)(C(=O)OCC(C)C)P

Isomeric SMILES

CCCCC(C(=O)C(=O)C1=C(C=C(C=C1C)C)C)(C(=O)OCC(C)C)P

InChI

InChI=1S/C21H31O4P/c1-7-8-9-21(26,20(24)25-12-13(2)3)19(23)18(22)17-15(5)10-14(4)11-16(17)6/h10-11,13H,7-9,12,26H2,1-6H3