2-(1,2,3-benzothiadiazol-7-ylcarbonyl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(1,2,3-benzothiadiazol-7-ylcarbonyl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(1,2,3-benzothiadiazole-7-carbonyl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1,2,3-benzothiadiazol-7-yl(oxo)methyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(1,2,3-benzothiadiazole-7-carbonyl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(1,2,3-benzothiadiazole-7-carbonyl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=O)C2=C3C(=CC=C2)N=NS3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(=O)C2=C3C(=CC=C2)N=NS3)C

InChI

InChI=1S/C15H14N2O3S/c1-15(2)6-10(18)12(11(19)7-15)13(20)8-4-3-5-9-14(8)21-17-16-9/h3-5,12H,6-7H2,1-2H3