tert-butyl 4,6,6-trimethyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-heptanoate

Systemtic Name: tert-butyl 4,6,6-trimethyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-heptanoate Openeye Name: tert-butyl 4,6,6-trimethyl-2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanyl-heptanoate CAS Name: 2-[1,2-dioxo-2-(2,4,6-trimethylphenyl)ethyl]-4,6,6-trimethyl-2-phosphinoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 4,6,6-trimethyl-2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanylheptanoate Traditional Name: 2-(2-keto-2-mesityl-acetyl)-4,6,6-trimethyl-2-phosphino-enanthic acid tert-butyl ester Formula: C25H39O4P MolecularWeight: 434.548521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)C(=O)C(CC(C)CC(C)(C)C)(C(=O)OC(C)(C)C)P)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C(=O)C(CC(C)CC(C)(C)C)(C(=O)OC(C)(C)C)P)C

InChI

InChI=1S/C25H39O4P/c1-15-11-17(3)19(18(4)12-15)20(26)21(27)25(30,22(28)29-24(8,9)10)14-16(2)13-23(5,6)7/h11-12,16H,13-14,30H2,1-10H3