2,2,2-tris(fluoranyl)-N-(7-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-(7-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2,2,2-trifluoro-N-(7-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2,2,2-trifluoro-N-(7-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2,2,2-trifluoro-N-(7-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2,2,2-trifluoro-N-(7-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C9H4F3N3O3S MolecularWeight: 291.20657

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C(F)(F)F

InChI

InChI=1S/C9H4F3N3O3S/c10-9(11,12)7(16)14-8-13-4-2-1-3-5(15(17)18)6(4)19-8/h1-3H,(H,13,14,16)