2-[6-acetamido-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoic acid

Systemtic Name: 2-[6-acetamido-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoic acid Openeye Name: 2-(6-acetamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid CAS Name: 2-(6-acetamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid IUPAC Name: 2-(6-acetamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid Traditional Name: 2-(6-acetamido-1,1,3-triketo-1,2-benzothiazol-2-yl)acetic acid Formula: C11H10N2O6S MolecularWeight: 298.2719

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=O)N(S2(=O)=O)CC(=O)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=O)N(S2(=O)=O)CC(=O)O

InChI

InChI=1S/C11H10N2O6S/c1-6(14)12-7-2-3-8-9(4-7)20(18,19)13(11(8)17)5-10(15)16/h2-4H,5H2,1H3,(H,12,14)(H,15,16)