tert-butyl (2R,3R)-2,3-dimethyl-5-oxidanylidene-5-(2,4,6-trimethylphenyl)pentanoate

Systemtic Name: tert-butyl (2R,3R)-2,3-dimethyl-5-oxidanylidene-5-(2,4,6-trimethylphenyl)pentanoate Openeye Name: tert-butyl (2R,3R)-2,3-dimethyl-5-oxo-5-(2,4,6-trimethylphenyl)pentanoate CAS Name: (2R,3R)-2,3-dimethyl-5-oxo-5-(2,4,6-trimethylphenyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R)-2,3-dimethyl-5-oxo-5-(2,4,6-trimethylphenyl)pentanoate Traditional Name: (2R,3R)-5-keto-5-mesityl-2,3-dimethyl-valeric acid tert-butyl ester Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C[C@@H](C)[C@@H](C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C20H30O3/c1-12-9-14(3)18(15(4)10-12)17(21)11-13(2)16(5)19(22)23-20(6,7)8/h9-10,13,16H,11H2,1-8H3/t13-,16-/m1/s1