3-methylbutyl 4-methyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-pentanoate

Systemtic Name: 3-methylbutyl 4-methyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-pentanoate Openeye Name: isopentyl 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 3-methylbutyl ester IUPAC Name: 3-methylbutyl 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 isoamyl ester Formula: C22H33O4P MolecularWeight: 392.468781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33O4P/c1-13(2)8-9-26-21(25)22(27,12-14(3)4)20(24)19(23)18-16(6)10-15(5)11-17(18)7/h10-11,13-14H,8-9,12,27H2,1-7H3