4-[6-acetyloxy-6-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)hexyl]benzoic acid

Systemtic Name: 4-[6-acetyloxy-6-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)hexyl]benzoic acid Openeye Name: 4-[6-acetoxy-6-(2-hydroxy-5-oxo-2H-furan-3-yl)hexyl]benzoic acid CAS Name: 4-[6-acetyloxy-6-(2-hydroxy-5-oxo-2H-furan-3-yl)hexyl]benzoic acid IUPAC Name: 4-[6-acetyloxy-6-(2-hydroxy-5-oxo-2H-furan-3-yl)hexyl]benzoic acid Traditional Name: 4-[6-acetoxy-6-(2-hydroxy-5-keto-2H-furan-3-yl)hexyl]benzoic acid Formula: C19H22O7 MolecularWeight: 362.37378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCCCC1=CC=C(C=C1)C(=O)O)C2=CC(=O)OC2O

Isomeric SMILES

CC(=O)OC(CCCCCC1=CC=C(C=C1)C(=O)O)C2=CC(=O)OC2O

InChI

InChI=1S/C19H22O7/c1-12(20)25-16(15-11-17(21)26-19(15)24)6-4-2-3-5-13-7-9-14(10-8-13)18(22)23/h7-11,16,19,24H,2-6H2,1H3,(H,22,23)