methyl 2,2,3-trimethyl-3-oxidanyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 2,2,3-trimethyl-3-oxidanyl-4-oxidanylidene-pentanoate Openeye Name: methyl 3-hydroxy-2,2,3-trimethyl-4-oxo-pentanoate CAS Name: 3-hydroxy-2,2,3-trimethyl-4-oxopentanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2,2,3-trimethyl-4-oxopentanoate Traditional Name: 3-hydroxy-4-keto-2,2,3-trimethyl-valeric acid methyl ester Formula: C9H16O4 MolecularWeight: 188.22094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C(C)(C)C(=O)OC)O

Isomeric SMILES

CC(=O)C(C)(C(C)(C)C(=O)OC)O

InChI

InChI=1S/C9H16O4/c1-6(10)9(4,12)8(2,3)7(11)13-5/h12H,1-5H3