5-fluoranyl-7-nitro-3-oxidanidyl-1,3-benzothiazol-3-ium-2-carboxamide

Systemtic Name: 5-fluoranyl-7-nitro-3-oxidanidyl-1,3-benzothiazol-3-ium-2-carboxamide Openeye Name: 5-fluoro-7-nitro-3-oxido-1,3-benzothiazol-3-ium-2-carboxamide CAS Name: 5-fluoro-7-nitro-3-oxido-1,3-benzothiazol-3-ium-2-carboxamide IUPAC Name: 5-fluoro-7-nitro-3-oxido-1,3-benzothiazol-3-ium-2-carboxamide Traditional Name: 5-fluoro-7-nitro-3-oxido-1,3-benzothiazol-3-ium-2-carboxamide Formula: C8H4FN3O4S MolecularWeight: 257.198463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1[N+](=O)[O-])SC(=[N+]2[O-])C(=O)N)F

Isomeric SMILES

C1=C(C=C2C(=C1[N+](=O)[O-])SC(=[N+]2[O-])C(=O)N)F

InChI

InChI=1S/C8H4FN3O4S/c9-3-1-4-6(5(2-3)12(15)16)17-8(7(10)13)11(4)14/h1-2H,(H2,10,13)