5,5-dimethyl-2-[(4-methyl-1,2,3-benzothiadiazol-5-yl)-oxidanyl-methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(4-methyl-1,2,3-benzothiadiazol-5-yl)-oxidanyl-methylidene]cyclohexane-1,3-dione Openeye Name: 2-[hydroxy-(4-methyl-1,2,3-benzothiadiazol-5-yl)methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[hydroxy-(4-methyl-1,2,3-benzothiadiazol-5-yl)methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[hydroxy-(4-methyl-1,2,3-benzothiadiazol-5-yl)methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[hydroxy-(4-methyl-1,2,3-benzothiadiazol-5-yl)methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=NS2)C(=C3C(=O)CC(CC3=O)(C)C)O

Isomeric SMILES

CC1=C(C=CC2=C1N=NS2)C(=C3C(=O)CC(CC3=O)(C)C)O

InChI

InChI=1S/C16H16N2O3S/c1-8-9(4-5-12-14(8)17-18-22-12)15(21)13-10(19)6-16(2,3)7-11(13)20/h4-5,21H,6-7H2,1-3H3