methyl 2,2-dimethyl-1,1-bis(oxidanylidene)-3,4-dihydrothiochromene-7-carboxylate

Systemtic Name: methyl 2,2-dimethyl-1,1-bis(oxidanylidene)-3,4-dihydrothiochromene-7-carboxylate Openeye Name: methyl 2,2-dimethyl-1,1-dioxo-3,4-dihydrothiochromene-7-carboxylate CAS Name: 2,2-dimethyl-1,1-dioxo-3,4-dihydro-1-benzothiopyran-7-carboxylic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-1,1-dioxo-3,4-dihydrothiochromene-7-carboxylate Traditional Name: 1,1-diketo-2,2-dimethyl-3,4-dihydrothiochromene-7-carboxylic acid methyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(S1(=O)=O)C=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1(CCC2=C(S1(=O)=O)C=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C13H16O4S/c1-13(2)7-6-9-4-5-10(12(14)17-3)8-11(9)18(13,15)16/h4-5,8H,6-7H2,1-3H3