3,4,6-trimethyl-2-oxidanylidene-1,3-benzothiazole-5-carboxylic acid

Systemtic Name: 3,4,6-trimethyl-2-oxidanylidene-1,3-benzothiazole-5-carboxylic acid Openeye Name: 3,4,6-trimethyl-2-oxo-1,3-benzothiazole-5-carboxylic acid CAS Name: 3,4,6-trimethyl-2-oxo-1,3-benzothiazole-5-carboxylic acid IUPAC Name: 3,4,6-trimethyl-2-oxo-1,3-benzothiazole-5-carboxylic acid Traditional Name: 2-keto-3,4,6-trimethyl-1,3-benzothiazole-5-carboxylic acid Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C(=O)O)C)N(C(=O)S2)C

Isomeric SMILES

CC1=CC2=C(C(=C1C(=O)O)C)N(C(=O)S2)C

InChI

InChI=1S/C11H11NO3S/c1-5-4-7-9(12(3)11(15)16-7)6(2)8(5)10(13)14/h4H,1-3H3,(H,13,14)