2-ethanoyl-4-oxidanyl-6-oxidanylidene-hexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene

Systemtic Name: 2-ethanoyl-4-oxidanyl-6-oxidanylidene-hexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene Openeye Name: 2-acetyl-4-hydroxy-6-oxo-hexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene CAS Name: 2-acetyl-4-hydroxy-6-oxohexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene IUPAC Name: 2-acetyl-4-hydroxy-6-oxohexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene Traditional Name: 2-acetyl-4-hydroxy-6-keto-hexanoic acid; 6-oxabicyclo[3.2.1]octa-1(8),2,4-triene Formula: C15H18O6 MolecularWeight: 294.29982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(CC=O)O)C(=O)O.C1C2=CC(=CC=C2)O1

Isomeric SMILES

CC(=O)C(CC(CC=O)O)C(=O)O.C1C2=CC(=CC=C2)O1

InChI

InChI=1S/C8H12O5.C7H6O/c1-5(10)7(8(12)13)4-6(11)2-3-9;1-2-6-4-7(3-1)8-5-6/h3,6-7,11H,2,4H2,1H3,(H,12,13);1-4H,5H2