3-tert-butyl-4-(methylamino)-1,1-bis(oxidanylidene)-1,2-benzothiazole-5-carboxylic acid

Systemtic Name: 3-tert-butyl-4-(methylamino)-1,1-bis(oxidanylidene)-1,2-benzothiazole-5-carboxylic acid Openeye Name: 3-tert-butyl-4-(methylamino)-1,1-dioxo-1,2-benzothiazole-5-carboxylic acid CAS Name: 3-tert-butyl-4-(methylamino)-1,1-dioxo-1,2-benzothiazole-5-carboxylic acid IUPAC Name: 3-tert-butyl-4-(methylamino)-1,1-dioxo-1,2-benzothiazole-5-carboxylic acid Traditional Name: 3-tert-butyl-1,1-diketo-4-(methylamino)-1,2-benzothiazole-5-carboxylic acid Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NS(=O)(=O)C2=C1C(=C(C=C2)C(=O)O)NC

Isomeric SMILES

CC(C)(C)C1=NS(=O)(=O)C2=C1C(=C(C=C2)C(=O)O)NC

InChI

InChI=1S/C13H16N2O4S/c1-13(2,3)11-9-8(20(18,19)15-11)6-5-7(12(16)17)10(9)14-4/h5-6,14H,1-4H3,(H,16,17)