4-oxidanylidene-4-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-6-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-6-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[(1,1,3-trioxo-1,2-benzothiazol-6-yl)amino]butanoic acid CAS Name: 4-oxo-4-[(1,1,3-trioxo-1,2-benzothiazol-6-yl)amino]butanoic acid IUPAC Name: 4-oxo-4-[(1,1,3-trioxo-1,2-benzothiazol-6-yl)amino]butanoic acid Traditional Name: 4-keto-4-[(1,1,3-triketo-1,2-benzothiazol-6-yl)amino]butyric acid Formula: C11H10N2O6S MolecularWeight: 298.2719

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=O

InChI

InChI=1S/C11H10N2O6S/c14-9(3-4-10(15)16)12-6-1-2-7-8(5-6)20(18,19)13-11(7)17/h1-2,5H,3-4H2,(H,12,14)(H,13,17)(H,15,16)