7-acetyloxy-4-oxidanylidene-2,3,4a,8a-tetrahydrochromene-2-carboxylic acid

Systemtic Name: 7-acetyloxy-4-oxidanylidene-2,3,4a,8a-tetrahydrochromene-2-carboxylic acid Openeye Name: 7-acetoxy-4-oxo-2,3,4a,8a-tetrahydrochromene-2-carboxylic acid CAS Name: 7-acetyloxy-4-oxo-2,3,4a,8a-tetrahydro-1-benzopyran-2-carboxylic acid IUPAC Name: 7-acetyloxy-4-oxo-2,3,4a,8a-tetrahydrochromene-2-carboxylic acid Traditional Name: 7-acetoxy-4-keto-2,3,4a,8a-tetrahydrochromene-2-carboxylic acid Formula: C12H12O6 MolecularWeight: 252.22008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2C(C=C1)C(=O)CC(O2)C(=O)O

Isomeric SMILES

CC(=O)OC1=CC2C(C=C1)C(=O)CC(O2)C(=O)O

InChI

InChI=1S/C12H12O6/c1-6(13)17-7-2-3-8-9(14)5-11(12(15)16)18-10(8)4-7/h2-4,8,10-11H,5H2,1H3,(H,15,16)