2,6-dimethyl-2-oxidanyl-3-oxidanylidene-heptanoate

Systemtic Name: 2,6-dimethyl-2-oxidanyl-3-oxidanylidene-heptanoate Openeye Name: 2-hydroxy-2,6-dimethyl-3-oxo-heptanoate CAS Name: 2-hydroxy-2,6-dimethyl-3-oxoheptanoate IUPAC Name: 2-hydroxy-2,6-dimethyl-3-oxoheptanoate Traditional Name: 2-hydroxy-3-keto-2,6-dimethyl-enanthate Formula: C9H15O4- MolecularWeight: 187.213

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)C(C)(C(=O)[O-])O

Isomeric SMILES

CC(C)CCC(=O)C(C)(C(=O)[O-])O

InChI

InChI=1S/C9H16O4/c1-6(2)4-5-7(10)9(3,13)8(11)12/h6,13H,4-5H2,1-3H3,(H,11,12)/p-1