5,8-bis(chloranyl)-4-methoxy-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylic acid

Systemtic Name: 5,8-bis(chloranyl)-4-methoxy-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylic acid Openeye Name: 5,8-dichloro-4-methoxy-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylic acid CAS Name: 5,8-dichloro-4-methoxy-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-carboxylic acid IUPAC Name: 5,8-dichloro-4-methoxy-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylic acid Traditional Name: 5,8-dichloro-1,1-diketo-4-methoxy-3,4-dihydro-2H-thiochromene-6-carboxylic acid Formula: C11H10Cl2O5S MolecularWeight: 325.1651

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCS(=O)(=O)C2=C(C=C(C(=C12)Cl)C(=O)O)Cl

Isomeric SMILES

COC1CCS(=O)(=O)C2=C(C=C(C(=C12)Cl)C(=O)O)Cl

InChI

InChI=1S/C11H10Cl2O5S/c1-18-7-2-3-19(16,17)10-6(12)4-5(11(14)15)9(13)8(7)10/h4,7H,2-3H2,1H3,(H,14,15)