2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]propanoic acid

Systemtic Name: 2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]propanoic acid Openeye Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propanoic acid CAS Name: 2-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]propanoic acid IUPAC Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propanoic acid Traditional Name: 2-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]propionic acid Formula: C12H12N2O4S MolecularWeight: 280.29968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C12H12N2O4S/c1-6(12(17)18)13-11(16)7-2-3-9-8(4-7)14-10(15)5-19-9/h2-4,6H,5H2,1H3,(H,13,16)(H,14,15)(H,17,18)