3-ethyl-2-oxidanylidene-1,3-benzothiazole-4-sulfonic acid

Systemtic Name: 3-ethyl-2-oxidanylidene-1,3-benzothiazole-4-sulfonic acid Openeye Name: 3-ethyl-2-oxo-1,3-benzothiazole-4-sulfonic acid CAS Name: 3-ethyl-2-oxo-1,3-benzothiazole-4-sulfonic acid IUPAC Name: 3-ethyl-2-oxo-1,3-benzothiazole-4-sulfonic acid Traditional Name: 3-ethyl-2-keto-1,3-benzothiazole-4-sulfonic acid Formula: C9H9NO4S2 MolecularWeight: 259.30206

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC=C2S(=O)(=O)O)SC1=O

Isomeric SMILES

CCN1C2=C(C=CC=C2S(=O)(=O)O)SC1=O

InChI

InChI=1S/C9H9NO4S2/c1-2-10-8-6(15-9(10)11)4-3-5-7(8)16(12,13)14/h3-5H,2H2,1H3,(H,12,13,14)