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

Systemtic Name: methyl 4-[[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C18H16N2O4S/c1-24-18(23)12-4-2-11(3-5-12)9-19-17(22)13-6-7-15-14(8-13)20-16(21)10-25-15/h2-8H,9-10H2,1H3,(H,19,22)(H,20,21)