3-[bis(chloranyl)methyl]-5-methyl-8-oxidanyl-4-oxidanylidene-2,3-dihydrochromene-6-carboxylate

Systemtic Name: 3-[bis(chloranyl)methyl]-5-methyl-8-oxidanyl-4-oxidanylidene-2,3-dihydrochromene-6-carboxylate Openeye Name: 3-(dichloromethyl)-8-hydroxy-5-methyl-4-oxo-chromane-6-carboxylate CAS Name: 3-(dichloromethyl)-8-hydroxy-5-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-carboxylate IUPAC Name: 3-(dichloromethyl)-8-hydroxy-5-methyl-4-oxo-2,3-dihydrochromene-6-carboxylate Traditional Name: 3-(dichloromethyl)-8-hydroxy-4-keto-5-methyl-chroman-6-carboxylate Formula: C12H9Cl2O5- MolecularWeight: 304.10286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)C(COC2=C(C=C1C(=O)[O-])O)C(Cl)Cl

Isomeric SMILES

CC1=C2C(=O)C(COC2=C(C=C1C(=O)[O-])O)C(Cl)Cl

InChI

InChI=1S/C12H10Cl2O5/c1-4-5(12(17)18)2-7(15)10-8(4)9(16)6(3-19-10)11(13)14/h2,6,11,15H,3H2,1H3,(H,17,18)/p-1