2-[[4-ethoxy-5-methyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]-4,4-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[4-ethoxy-5-methyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]-4,4-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(4-ethoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)-4,4-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(4-ethoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-yl)-oxomethyl]-4,4-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(4-ethoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)-4,4-dimethylcyclohexane-1,3-dione Traditional Name: 2-(4-ethoxy-1,1-diketo-5-methyl-3,4-dihydro-2H-thiochromene-6-carbonyl)-4,4-dimethyl-cyclohexane-1,3-quinone Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCS(=O)(=O)C2=C1C(=C(C=C2)C(=O)C3C(=O)CCC(C3=O)(C)C)C

Isomeric SMILES

CCOC1CCS(=O)(=O)C2=C1C(=C(C=C2)C(=O)C3C(=O)CCC(C3=O)(C)C)C

InChI

InChI=1S/C21H26O6S/c1-5-27-15-9-11-28(25,26)16-7-6-13(12(2)17(15)16)19(23)18-14(22)8-10-21(3,4)20(18)24/h6-7,15,18H,5,8-11H2,1-4H3