3-ethanoyl-2-methyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-ethanoyl-2-methyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-acetyl-2-methyl-4-oxo-pentanoic acid CAS Name: 3-acetyl-2-methyl-4-oxopentanoic acid IUPAC Name: 3-acetyl-2-methyl-4-oxopentanoic acid Traditional Name: 3-acetyl-4-keto-2-methyl-valeric acid Formula: C8H12O4 MolecularWeight: 172.17848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12O4/c1-4(8(11)12)7(5(2)9)6(3)10/h4,7H,1-3H3,(H,11,12)