7-nitro-3-oxidanyl-5-(trifluoromethyl)-1,3-benzothiazol-2-one

Systemtic Name: 7-nitro-3-oxidanyl-5-(trifluoromethyl)-1,3-benzothiazol-2-one Openeye Name: 3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-one CAS Name: 3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-one IUPAC Name: 3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-one Traditional Name: 3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-one Formula: C8H3F3N2O4S MolecularWeight: 280.18063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1N(C(=O)S2)O)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=C(C2=C1N(C(=O)S2)O)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C8H3F3N2O4S/c9-8(10,11)3-1-4-6(5(2-3)13(16)17)18-7(14)12(4)15/h1-2,15H