2-[(3,4-dimethyl-2-oxidanylidene-1,3-benzothiazol-5-yl)carbonyl]cyclohexane-1,3-dione

Systemtic Name: 2-[(3,4-dimethyl-2-oxidanylidene-1,3-benzothiazol-5-yl)carbonyl]cyclohexane-1,3-dione Openeye Name: 2-(3,4-dimethyl-2-oxo-1,3-benzothiazole-5-carbonyl)cyclohexane-1,3-dione CAS Name: 2-[(3,4-dimethyl-2-oxo-1,3-benzothiazol-5-yl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(3,4-dimethyl-2-oxo-1,3-benzothiazole-5-carbonyl)cyclohexane-1,3-dione Traditional Name: 2-(2-keto-3,4-dimethyl-1,3-benzothiazole-5-carbonyl)cyclohexane-1,3-quinone Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=O)S2)C)C(=O)C3C(=O)CCCC3=O

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=O)S2)C)C(=O)C3C(=O)CCCC3=O

InChI

InChI=1S/C16H15NO4S/c1-8-9(6-7-12-14(8)17(2)16(21)22-12)15(20)13-10(18)4-3-5-11(13)19/h6-7,13H,3-5H2,1-2H3