methyl 3-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]benzoate

Systemtic Name: methyl 3-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]benzoate Openeye Name: methyl 3-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]benzoate CAS Name: 3-[[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]benzoate Traditional Name: 3-[3-(3-keto-1,4-benzothiazin-4-yl)propanoylamino]benzoic acid methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C19H18N2O4S/c1-25-19(24)13-5-4-6-14(11-13)20-17(22)9-10-21-15-7-2-3-8-16(15)26-12-18(21)23/h2-8,11H,9-10,12H2,1H3,(H,20,22)