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

Systemtic Name: 2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]pentanoic acid Openeye Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]pentanoic acid CAS Name: 2-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]pentanoic acid IUPAC Name: 2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]pentanoic acid Traditional Name: 2-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]valeric acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4S/c1-2-3-9(14(19)20)16-13(18)8-4-5-11-10(6-8)15-12(17)7-21-11/h4-6,9H,2-3,7H2,1H3,(H,15,17)(H,16,18)(H,19,20)