3-ethyl-2-(furan-3-ylcarbonyl)octanoic acid

Systemtic Name: 3-ethyl-2-(furan-3-ylcarbonyl)octanoic acid Openeye Name: 3-ethyl-2-(furan-3-carbonyl)octanoic acid CAS Name: 3-ethyl-2-[3-furanyl(oxo)methyl]octanoic acid IUPAC Name: 3-ethyl-2-(furan-3-carbonyl)octanoic acid Traditional Name: 3-ethyl-2-(3-furoyl)caprylic acid Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C(C(=O)C1=COC=C1)C(=O)O

Isomeric SMILES

CCCCCC(CC)C(C(=O)C1=COC=C1)C(=O)O

InChI

InChI=1S/C15H22O4/c1-3-5-6-7-11(4-2)13(15(17)18)14(16)12-8-9-19-10-12/h8-11,13H,3-7H2,1-2H3,(H,17,18)