N-(2-methylphenyl)-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(2-methylphenyl)-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: 2,6-dinitro-N-(o-tolyl)-4-(trifluoromethyl)aniline CAS Name: N-(2-methylphenyl)-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-(2-methylphenyl)-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-(o-tolyl)amine Formula: C14H10F3N3O4 MolecularWeight: 341.24211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F3N3O4/c1-8-4-2-3-5-10(8)18-13-11(19(21)22)6-9(14(15,16)17)7-12(13)20(23)24/h2-7,18H,1H3