(E)-diazenyl-[7-nitro-3-oxidanyl-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol

Systemtic Name: (E)-diazenyl-[7-nitro-3-oxidanyl-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol Openeye Name: (E)-diazenyl-[3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol CAS Name: (E)-diazenyl-[3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol IUPAC Name: (E)-diazenyl-[3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol Traditional Name: (E)-diazenyl-[3-hydroxy-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]methanol Formula: C9H5F3N4O4S MolecularWeight: 322.22061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H5F3N4O4S/c10-9(11,12)3-1-4-6(5(2-3)16(19)20)21-8(15(4)18)7(17)14-13/h1-2,13,17-18H/b8-7+,14-13?