6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)benzimidazolo[1,2-b]isoquinolin-11-olate

Systemtic Name: 6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)benzimidazolo[1,2-b]isoquinolin-11-olate Openeye Name: 6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)benzimidazolo[1,2-b]isoquinolin-11-olate CAS Name: 6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)-11-benzimidazolo[1,2-b]isoquinolinolate IUPAC Name: 6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)benzimidazolo[1,2-b]isoquinolin-11-olate Traditional Name: 6-(3-methoxyphenyl)-9-nitro-2-(trifluoromethyl)benzimidazol[1,2-b]isoquinolin-11-olate Formula: C23H13F3N3O4- MolecularWeight: 452.36223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CC(=CC3=C(N4C2=NC5=C4C=C(C=C5)C(F)(F)F)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CC(=CC3=C(N4C2=NC5=C4C=C(C=C5)C(F)(F)F)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H14F3N3O4/c1-33-15-4-2-3-12(9-15)20-16-7-6-14(29(31)32)11-17(16)22(30)28-19-10-13(23(24,25)26)5-8-18(19)27-21(20)28/h2-11,30H,1H3/p-1