2-(4H-1,2-benzothiazin-6-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(4H-1,2-benzothiazin-6-yl)-4-oxidanylidene-butanoic acid Openeye Name: 2-(4H-1,2-benzothiazin-6-yl)-4-oxo-butanoic acid CAS Name: 2-(4H-1,2-benzothiazin-6-yl)-4-oxobutanoic acid IUPAC Name: 2-(4H-1,2-benzothiazin-6-yl)-4-oxobutanoic acid Traditional Name: 2-(4H-1,2-benzothiazin-6-yl)-4-keto-butyric acid Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NSC2=C1C=C(C=C2)C(CC=O)C(=O)O

Isomeric SMILES

C1C=NSC2=C1C=C(C=C2)C(CC=O)C(=O)O

InChI

InChI=1S/C12H11NO3S/c14-6-4-10(12(15)16)8-1-2-11-9(7-8)3-5-13-17-11/h1-2,5-7,10H,3-4H2,(H,15,16)