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

Systemtic Name: 2-[[5-methyl-1,1-bis(oxidanylidene)-4-propan-2-yloxy-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]cyclohexane-1,3-dione Openeye Name: 2-(4-isopropoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-dione CAS Name: 2-[(5-methyl-1,1-dioxo-4-propan-2-yloxy-3,4-dihydro-2H-1-benzothiopyran-6-yl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(5-methyl-1,1-dioxo-4-propan-2-yloxy-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-dione Traditional Name: 2-(4-isopropoxy-1,1-diketo-5-methyl-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-quinone Formula: C20H24O6S MolecularWeight: 392.46596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(CCS2(=O)=O)OC(C)C)C(=O)C3C(=O)CCCC3=O

Isomeric SMILES

CC1=C(C=CC2=C1C(CCS2(=O)=O)OC(C)C)C(=O)C3C(=O)CCCC3=O

InChI

InChI=1S/C20H24O6S/c1-11(2)26-16-9-10-27(24,25)17-8-7-13(12(3)18(16)17)20(23)19-14(21)5-4-6-15(19)22/h7-8,11,16,19H,4-6,9-10H2,1-3H3