butyl 3-methyl-2-oxidanyl-4-oxidanylidene-hexanoate

Systemtic Name: butyl 3-methyl-2-oxidanyl-4-oxidanylidene-hexanoate Openeye Name: butyl 2-hydroxy-3-methyl-4-oxo-hexanoate CAS Name: 2-hydroxy-3-methyl-4-oxohexanoic acid butyl ester IUPAC Name: butyl 2-hydroxy-3-methyl-4-oxohexanoate Traditional Name: 2-hydroxy-4-keto-3-methyl-hexanoic acid butyl ester Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C(C)C(=O)CC)O

Isomeric SMILES

CCCCOC(=O)C(C(C)C(=O)CC)O

InChI

InChI=1S/C11H20O4/c1-4-6-7-15-11(14)10(13)8(3)9(12)5-2/h8,10,13H,4-7H2,1-3H3