(4-bromanyl-2-fluoranyl-phenyl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H11BrFNO3S MolecularWeight: 396.230843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H11BrFNO3S/c17-11-3-1-10(12(18)6-11)7-22-16(21)9-2-4-14-13(5-9)19-15(20)8-23-14/h1-6H,7-8H2,(H,19,20)