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

Systemtic Name: 4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxylate Openeye Name: 4-[(2-chloro-4-fluoro-phenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxylate CAS Name: 4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxylate IUPAC Name: 4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-benzyl)-3-keto-1,4-benzothiazine-6-carboxylate Formula: C16H10ClFNO3S- MolecularWeight: 350.771903

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(S1)C=CC(=C2)C(=O)[O-])CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1C(=O)N(C2=C(S1)C=CC(=C2)C(=O)[O-])CC3=C(C=C(C=C3)F)Cl

InChI

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