methyl 2-[[[3-nitro-4-(trifluoromethyl)phenyl]amino]diazenyl]benzoate

Systemtic Name: methyl 2-[[[3-nitro-4-(trifluoromethyl)phenyl]amino]diazenyl]benzoate Openeye Name: methyl 2-[3-nitro-4-(trifluoromethyl)anilino]azobenzoate CAS Name: 2-[3-nitro-4-(trifluoromethyl)anilino]azobenzoic acid methyl ester IUPAC Name: methyl 2-[[3-nitro-4-(trifluoromethyl)anilino]diazenyl]benzoate Traditional Name: 2-[3-nitro-4-(trifluoromethyl)anilino]azobenzoic acid methyl ester Formula: C15H11F3N4O4 MolecularWeight: 368.26745

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N=NNC2=CC(=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1N=NNC2=CC(=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11F3N4O4/c1-26-14(23)10-4-2-3-5-12(10)20-21-19-9-6-7-11(15(16,17)18)13(8-9)22(24)25/h2-8H,1H3,(H,19,20)