methyl 3-oxidanyl-2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]propionic acid methyl ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C13H14N2O5S/c1-20-13(19)9(5-16)15-12(18)7-2-3-10-8(4-7)14-11(17)6-21-10/h2-4,9,16H,5-6H2,1H3,(H,14,17)(H,15,18)