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

Systemtic Name: 2-[[4-methoxy-5-methyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]cyclohexane-1,3-dione Openeye Name: 2-(4-methoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-dione CAS Name: 2-[(4-methoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-yl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(4-methoxy-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-dione Traditional Name: 2-(1,1-diketo-4-methoxy-5-methyl-3,4-dihydro-2H-thiochromene-6-carbonyl)cyclohexane-1,3-quinone Formula: C18H20O6S MolecularWeight: 364.4128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O6S/c1-10-11(18(21)17-12(19)4-3-5-13(17)20)6-7-15-16(10)14(24-2)8-9-25(15,22)23/h6-7,14,17H,3-5,8-9H2,1-2H3