2-[4-(4-methyloctanoyl)-5-oxidanyl-3-oxidanylidene-furan-2-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methyloctanoyl)-5-oxidanyl-3-oxidanylidene-furan-2-yl]ethanoic acid Openeye Name: 2-[5-hydroxy-4-(4-methyloctanoyl)-3-oxo-2-furyl]acetic acid CAS Name: 2-[5-hydroxy-4-(4-methyl-1-oxooctyl)-3-oxo-2-furanyl]acetic acid IUPAC Name: 2-[5-hydroxy-4-(4-methyloctanoyl)-3-oxofuran-2-yl]acetic acid Traditional Name: 2-[5-hydroxy-3-keto-4-(4-methyloctanoyl)-2-furyl]acetic acid Formula: C15H22O6 MolecularWeight: 298.33158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CCC(=O)C1=C(OC(C1=O)CC(=O)O)O

Isomeric SMILES

CCCCC(C)CCC(=O)C1=C(OC(C1=O)CC(=O)O)O

InChI

InChI=1S/C15H22O6/c1-3-4-5-9(2)6-7-10(16)13-14(19)11(8-12(17)18)21-15(13)20/h9,11,20H,3-8H2,1-2H3,(H,17,18)