N-ethyl-2,6-dinitro-N-propan-2-yl-4-(trifluoromethyl)aniline

Systemtic Name: N-ethyl-2,6-dinitro-N-propan-2-yl-4-(trifluoromethyl)aniline Openeye Name: N-ethyl-N-isopropyl-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-ethyl-2,6-dinitro-N-propan-2-yl-4-(trifluoromethyl)aniline IUPAC Name: N-ethyl-2,6-dinitro-N-propan-2-yl-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-ethyl-isopropyl-amine Formula: C12H14F3N3O4 MolecularWeight: 321.25247

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCN(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C12H14F3N3O4/c1-4-16(7(2)3)11-9(17(19)20)5-8(12(13,14)15)6-10(11)18(21)22/h5-7H,4H2,1-3H3