2,6-dimethyl-3-oxidanylidene-octanoic acid

Systemtic Name: 2,6-dimethyl-3-oxidanylidene-octanoic acid Openeye Name: 2,6-dimethyl-3-oxo-octanoic acid CAS Name: 2,6-dimethyl-3-oxooctanoic acid IUPAC Name: 2,6-dimethyl-3-oxooctanoic acid Traditional Name: 3-keto-2,6-dimethyl-caprylic acid Formula: C10H18O3 MolecularWeight: 186.24812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H18O3/c1-4-7(2)5-6-9(11)8(3)10(12)13/h7-8H,4-6H2,1-3H3,(H,12,13)