(2-chloranyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) furan-2-carboxylate

Systemtic Name: (2-chloranyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) furan-2-carboxylate Openeye Name: (2-chloro-5,5-dimethyl-3-oxo-cyclohexen-1-yl) furan-2-carboxylate CAS Name: 2-furancarboxylic acid (2-chloro-5,5-dimethyl-3-oxo-1-cyclohexenyl) ester IUPAC Name: (2-chloro-5,5-dimethyl-3-oxocyclohexen-1-yl) furan-2-carboxylate Traditional Name: furan-2-carboxylic acid (2-chloro-3-keto-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C13H13ClO4 MolecularWeight: 268.69292

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)Cl)OC(=O)C2=CC=CO2)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)Cl)OC(=O)C2=CC=CO2)C

InChI

InChI=1S/C13H13ClO4/c1-13(2)6-8(15)11(14)10(7-13)18-12(16)9-4-3-5-17-9/h3-5H,6-7H2,1-2H3