methyl 4-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-triene-1-carboxylate

Systemtic Name: methyl 4-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-triene-1-carboxylate Openeye Name: methyl 4-hydroxy-3-oxo-cyclohepta-1,4,6-triene-1-carboxylate CAS Name: 4-hydroxy-3-oxo-1-cyclohepta-1,4,6-trienecarboxylic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-oxocyclohepta-1,4,6-triene-1-carboxylate Traditional Name: 4-hydroxy-3-keto-cyclohepta-1,4,6-triene-1-carboxylic acid methyl ester Formula: C9H8O4 MolecularWeight: 180.15742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8O4/c1-13-9(12)6-3-2-4-7(10)8(11)5-6/h2-5H,1H3,(H,10,11)