N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(trifluoromethoxy)benzenesulfonamide Formula: C14H8F3N3O5S2 MolecularWeight: 419.35563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H8F3N3O5S2/c15-14(16,17)25-9-2-4-10(5-3-9)27(23,24)19-13-18-11-6-1-8(20(21)22)7-12(11)26-13/h1-7H,(H,18,19)