methyl 2-methoxy-3-oxidanylidene-cyclohepta-1,4,6-triene-1-carboxylate

Systemtic Name: methyl 2-methoxy-3-oxidanylidene-cyclohepta-1,4,6-triene-1-carboxylate Openeye Name: methyl 2-methoxy-3-oxo-cyclohepta-1,4,6-triene-1-carboxylate CAS Name: 2-methoxy-3-oxo-1-cyclohepta-1,4,6-trienecarboxylic acid methyl ester IUPAC Name: methyl 2-methoxy-3-oxocyclohepta-1,4,6-triene-1-carboxylate Traditional Name: 3-keto-2-methoxy-cyclohepta-1,4,6-triene-1-carboxylic acid methyl ester Formula: C10H10O4 MolecularWeight: 194.184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=CC1=O)C(=O)OC

Isomeric SMILES

COC1=C(C=CC=CC1=O)C(=O)OC

InChI

InChI=1S/C10H10O4/c1-13-9-7(10(12)14-2)5-3-4-6-8(9)11/h3-6H,1-2H3