2-(2-oxidanylidenepentan-3-yl)hexanoic acid

Systemtic Name: 2-(2-oxidanylidenepentan-3-yl)hexanoic acid Openeye Name: 2-(1-ethyl-2-oxo-propyl)hexanoic acid CAS Name: 2-(2-oxopentan-3-yl)hexanoic acid IUPAC Name: 2-(2-oxopentan-3-yl)hexanoic acid Traditional Name: 2-(1-ethyl-2-keto-propyl)hexanoic acid Formula: C11H20O3 MolecularWeight: 200.2747

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O3/c1-4-6-7-10(11(13)14)9(5-2)8(3)12/h9-10H,4-7H2,1-3H3,(H,13,14)