2-[[8-methyl-4,4-bis(oxidanylidene)-2,3-dihydro-1,4$l^{6}-benzoxathiin-7-yl]carbonyl]cyclohexane-1,3-dione

Systemtic Name: 2-[[8-methyl-4,4-bis(oxidanylidene)-2,3-dihydro-1,4$l^{6}-benzoxathiin-7-yl]carbonyl]cyclohexane-1,3-dione Openeye Name: 2-(8-methyl-4,4-dioxo-2,3-dihydro-1,4$l^{6}-benzoxathiine-7-carbonyl)cyclohexane-1,3-dione CAS Name: 2-[(8-methyl-4,4-dioxo-2,3-dihydro-1,4$l^{6}-benzoxathiin-7-yl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(8-methyl-4,4-dioxo-2,3-dihydro-1,4$l^{6}-benzoxathiine-7-carbonyl)cyclohexane-1,3-dione Traditional Name: 2-(4,4-diketo-8-methyl-2,3-dihydro-1,4$l^{6}-benzoxathiin-7-carbonyl)cyclohexane-1,3-quinone Formula: C16H16O6S MolecularWeight: 336.35964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OCCS2(=O)=O)C(=O)C3C(=O)CCCC3=O

Isomeric SMILES

CC1=C(C=CC2=C1OCCS2(=O)=O)C(=O)C3C(=O)CCCC3=O

InChI

InChI=1S/C16H16O6S/c1-9-10(15(19)14-11(17)3-2-4-12(14)18)5-6-13-16(9)22-7-8-23(13,20)21/h5-6,14H,2-4,7-8H2,1H3