methyl 5,6,6-trimethyl-5-oxidanyl-3-oxidanylidene-heptanoate

Systemtic Name: methyl 5,6,6-trimethyl-5-oxidanyl-3-oxidanylidene-heptanoate Openeye Name: methyl 5-hydroxy-5,6,6-trimethyl-3-oxo-heptanoate CAS Name: 5-hydroxy-5,6,6-trimethyl-3-oxoheptanoic acid methyl ester IUPAC Name: methyl 5-hydroxy-5,6,6-trimethyl-3-oxoheptanoate Traditional Name: 5-hydroxy-3-keto-5,6,6-trimethyl-enanthic acid methyl ester Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O4/c1-10(2,3)11(4,14)7-8(12)6-9(13)15-5/h14H,6-7H2,1-5H3