3-ethyl-2-(1,3-oxazol-4-ylcarbonyl)octanoate

Systemtic Name: 3-ethyl-2-(1,3-oxazol-4-ylcarbonyl)octanoate Openeye Name: 3-ethyl-2-(oxazole-4-carbonyl)octanoate CAS Name: 3-ethyl-2-[4-oxazolyl(oxo)methyl]octanoate IUPAC Name: 3-ethyl-2-(1,3-oxazole-4-carbonyl)octanoate Traditional Name: 3-ethyl-2-(oxazole-4-carbonyl)caprylate Formula: C14H20NO4- MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C(C(=O)C1=COC=N1)C(=O)[O-]

Isomeric SMILES

CCCCCC(CC)C(C(=O)C1=COC=N1)C(=O)[O-]

InChI

InChI=1S/C14H21NO4/c1-3-5-6-7-10(4-2)12(14(17)18)13(16)11-8-19-9-15-11/h8-10,12H,3-7H2,1-2H3,(H,17,18)/p-1