tert-butyl 4-methyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-pentanoate

Systemtic Name: tert-butyl 4-methyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-pentanoate Openeye Name: tert-butyl 4-methyl-2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanyl-pentanoate CAS Name: 2-[1,2-dioxo-2-(2,4,6-trimethylphenyl)ethyl]-4-methyl-2-phosphinopentanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-methyl-2-[2-oxo-2-(2,4,6-trimethylphenyl)acetyl]-2-phosphanylpentanoate Traditional Name: 2-(2-keto-2-mesityl-acetyl)-4-methyl-2-phosphino-valeric acid tert-butyl ester Formula: C21H31O4P MolecularWeight: 378.442201

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H31O4P/c1-12(2)11-21(26,19(24)25-20(6,7)8)18(23)17(22)16-14(4)9-13(3)10-15(16)5/h9-10,12H,11,26H2,1-8H3