4,4-dimethyl-3-oxidanyl-5-oxidanylidene-heptanoic acid

Systemtic Name: 4,4-dimethyl-3-oxidanyl-5-oxidanylidene-heptanoic acid Openeye Name: 3-hydroxy-4,4-dimethyl-5-oxo-heptanoic acid CAS Name: 3-hydroxy-4,4-dimethyl-5-oxoheptanoic acid IUPAC Name: 3-hydroxy-4,4-dimethyl-5-oxoheptanoic acid Traditional Name: 3-hydroxy-5-keto-4,4-dimethyl-enanthic acid Formula: C9H16O4 MolecularWeight: 188.22094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C)C(CC(=O)O)O

Isomeric SMILES

CCC(=O)C(C)(C)C(CC(=O)O)O

InChI

InChI=1S/C9H16O4/c1-4-6(10)9(2,3)7(11)5-8(12)13/h7,11H,4-5H2,1-3H3,(H,12,13)