4-[methyl-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]amino]butanoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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