2-azanyl-3-(5-oxidanyl-3-oxidanylidene-4H-1,4-benzothiazin-7-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(5-oxidanyl-3-oxidanylidene-4H-1,4-benzothiazin-7-yl)propanoic acid Openeye Name: 2-amino-3-(5-hydroxy-3-oxo-4H-1,4-benzothiazin-7-yl)propanoic acid CAS Name: 2-amino-3-(5-hydroxy-3-oxo-4H-1,4-benzothiazin-7-yl)propanoic acid IUPAC Name: 2-amino-3-(5-hydroxy-3-oxo-4H-1,4-benzothiazin-7-yl)propanoic acid Traditional Name: 2-amino-3-(5-hydroxy-3-keto-4H-1,4-benzothiazin-7-yl)propionic acid Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O

InChI

InChI=1S/C11H12N2O4S/c12-6(11(16)17)1-5-2-7(14)10-8(3-5)18-4-9(15)13-10/h2-3,6,14H,1,4,12H2,(H,13,15)(H,16,17)