ethyl 1-methyl-4-oxidanylidene-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: ethyl 1-methyl-4-oxidanylidene-cyclohexa-2,5-diene-1-carboxylate Openeye Name: ethyl 1-methyl-4-oxo-cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-methyl-4-oxo-1-cyclohexa-2,5-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-oxocyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-keto-1-methyl-cyclohexa-2,5-diene-1-carboxylic acid ethyl ester Formula: C10H12O3 MolecularWeight: 180.20048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=CC(=O)C=C1)C

Isomeric SMILES

CCOC(=O)C1(C=CC(=O)C=C1)C

InChI

InChI=1S/C10H12O3/c1-3-13-9(12)10(2)6-4-8(11)5-7-10/h4-7H,3H2,1-2H3