3,5-dimethyl-6-oxidanylidene-heptanoic acid

Systemtic Name: 3,5-dimethyl-6-oxidanylidene-heptanoic acid Openeye Name: 3,5-dimethyl-6-oxo-heptanoic acid CAS Name: 3,5-dimethyl-6-oxoheptanoic acid IUPAC Name: 3,5-dimethyl-6-oxoheptanoic acid Traditional Name: 6-keto-3,5-dimethyl-enanthic acid Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O3/c1-6(5-9(11)12)4-7(2)8(3)10/h6-7H,4-5H2,1-3H3,(H,11,12)