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

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C16H11ClFNO3S MolecularWeight: 351.779843

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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)F)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClFNO3S/c17-12-6-11(18)3-1-10(12)7-22-16(21)9-2-4-14-13(5-9)19-15(20)8-23-14/h1-6H,7-8H2,(H,19,20)