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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C13H14N2O4S/c1-19-12(17)4-5-14-13(18)8-2-3-10-9(6-8)15-11(16)7-20-10/h2-3,6H,4-5,7H2,1H3,(H,14,18)(H,15,16)