(5-ethanoyl-2-ethoxy-phenyl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C20H19NO5S/c1-3-25-17-6-4-13(12(2)22)8-15(17)10-26-20(24)14-5-7-18-16(9-14)21-19(23)11-27-18/h4-9H,3,10-11H2,1-2H3,(H,21,23)