methyl 4,6-dimethyl-1,1-bis(oxidanylidene)-2H-thiochromene-7-carboxylate

Systemtic Name: methyl 4,6-dimethyl-1,1-bis(oxidanylidene)-2H-thiochromene-7-carboxylate Openeye Name: methyl 4,6-dimethyl-1,1-dioxo-2H-thiochromene-7-carboxylate CAS Name: 4,6-dimethyl-1,1-dioxo-2H-1-benzothiopyran-7-carboxylic acid methyl ester IUPAC Name: methyl 4,6-dimethyl-1,1-dioxo-2H-thiochromene-7-carboxylate Traditional Name: 1,1-diketo-4,6-dimethyl-2H-thiochromene-7-carboxylic acid methyl ester Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCS(=O)(=O)C2=CC(=C(C=C12)C)C(=O)OC

Isomeric SMILES

CC1=CCS(=O)(=O)C2=CC(=C(C=C12)C)C(=O)OC

InChI

InChI=1S/C13H14O4S/c1-8-4-5-18(15,16)12-7-11(13(14)17-3)9(2)6-10(8)12/h4,6-7H,5H2,1-3H3