methyl 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]benzoate

Systemtic Name: methyl 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]benzoate Openeye Name: methyl 2-[2,6-dinitro-4-(trifluoromethyl)anilino]benzoate CAS Name: 2-[2,6-dinitro-4-(trifluoromethyl)anilino]benzoic acid methyl ester IUPAC Name: methyl 2-[2,6-dinitro-4-(trifluoromethyl)anilino]benzoate Traditional Name: 2-[2,6-dinitro-4-(trifluoromethyl)anilino]benzoic acid methyl ester Formula: C15H10F3N3O6 MolecularWeight: 385.25161

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H10F3N3O6/c1-27-14(22)9-4-2-3-5-10(9)19-13-11(20(23)24)6-8(15(16,17)18)7-12(13)21(25)26/h2-7,19H,1H3