methyl 2,4,4-trimethyl-5-oxidanylidene-pentanoate

Systemtic Name: methyl 2,4,4-trimethyl-5-oxidanylidene-pentanoate Openeye Name: methyl 2,4,4-trimethyl-5-oxo-pentanoate CAS Name: 2,4,4-trimethyl-5-oxopentanoic acid methyl ester IUPAC Name: methyl 2,4,4-trimethyl-5-oxopentanoate Traditional Name: 5-keto-2,4,4-trimethyl-valeric acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O3/c1-7(8(11)12-4)5-9(2,3)6-10/h6-7H,5H2,1-4H3