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

Systemtic Name: 2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]butanoic acid Openeye Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]butanoic acid CAS Name: 2-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]butanoic acid IUPAC Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]butanoic acid Traditional Name: 2-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]butyric acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O4S/c1-2-8(13(18)19)15-12(17)7-3-4-10-9(5-7)14-11(16)6-20-10/h3-5,8H,2,6H2,1H3,(H,14,16)(H,15,17)(H,18,19)