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

Systemtic Name: octyl 4,6,6-trimethyl-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethanoyl]-2-phosphanyl-heptanoate Openeye Name: octyl 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 octyl ester IUPAC Name: octyl 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 octyl ester Formula: C29H47O4P MolecularWeight: 490.654841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC(C)CC(C)(C)C)(C(=O)C(=O)C1=C(C=C(C=C1C)C)C)P

Isomeric SMILES

CCCCCCCCOC(=O)C(CC(C)CC(C)(C)C)(C(=O)C(=O)C1=C(C=C(C=C1C)C)C)P

InChI

InChI=1S/C29H47O4P/c1-9-10-11-12-13-14-15-33-27(32)29(34,19-21(3)18-28(6,7)8)26(31)25(30)24-22(4)16-20(2)17-23(24)5/h16-17,21H,9-15,18-19,34H2,1-8H3