methyl 3,3-dimethyl-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: methyl 3,3-dimethyl-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate Openeye Name: methyl 3,3-dimethyl-6-oxo-cyclohexa-1,4-diene-1-carboxylate CAS Name: 3,3-dimethyl-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 3,3-dimethyl-6-oxocyclohexa-1,4-diene-1-carboxylate Traditional Name: 6-keto-3,3-dimethyl-cyclohexa-1,4-diene-1-carboxylic acid methyl ester Formula: C10H12O3 MolecularWeight: 180.20048

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C(=C1)C(=O)OC)C

Isomeric SMILES

CC1(C=CC(=O)C(=C1)C(=O)OC)C

InChI

InChI=1S/C10H12O3/c1-10(2)5-4-8(11)7(6-10)9(12)13-3/h4-6H,1-3H3