N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: (2-chloro-6-fluoro-benzyl)-[2,6-dinitro-4-(trifluoromethyl)phenyl]-ethyl-amine Formula: C16H12ClF4N3O4 MolecularWeight: 421.730793

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3