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

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl)methyl (2R)-2-methyl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (2-bromo-4-fluoro-phenyl)methyl (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylic acid (2-bromo-4-fluorophenyl)methyl ester IUPAC Name: (2-bromo-4-fluorophenyl)methyl (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: (2R)-3-keto-2-methyl-4H-1,4-benzothiazine-6-carboxylic acid (2-bromo-4-fluoro-benzyl) ester Formula: C17H13BrFNO3S MolecularWeight: 410.257423

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=C(C=C(C=C3)F)Br

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C17H13BrFNO3S/c1-9-16(21)20-14-6-10(3-5-15(14)24-9)17(22)23-8-11-2-4-12(19)7-13(11)18/h2-7,9H,8H2,1H3,(H,20,21)/t9-/m1/s1