dimethyl 6,6-dimethyl-1-methylsulfanyl-8-oxidanylidene-7H-isothiochromene-3,4-dicarboxylate

Systemtic Name: dimethyl 6,6-dimethyl-1-methylsulfanyl-8-oxidanylidene-7H-isothiochromene-3,4-dicarboxylate Openeye Name: dimethyl 6,6-dimethyl-1-methylsulfanyl-8-oxo-7H-isothiochromene-3,4-dicarboxylate CAS Name: 6,6-dimethyl-1-(methylthio)-8-oxo-7H-2-benzothiopyran-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6,6-dimethyl-1-methylsulfanyl-8-oxo-7H-isothiochromene-3,4-dicarboxylate Traditional Name: 8-keto-6,6-dimethyl-1-(methylthio)-7H-isothiochromene-3,4-dicarboxylic acid dimethyl ester Formula: C16H18O5S2 MolecularWeight: 354.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(SC(=C(C2=C1)C(=O)OC)C(=O)OC)SC)C

Isomeric SMILES

CC1(CC(=O)C2=C(SC(=C(C2=C1)C(=O)OC)C(=O)OC)SC)C

InChI

InChI=1S/C16H18O5S2/c1-16(2)6-8-10(9(17)7-16)15(22-5)23-12(14(19)21-4)11(8)13(18)20-3/h6H,7H2,1-5H3