2,4-dinitro-N3,5-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine

Systemtic Name: 2,4-dinitro-N3,5-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine Openeye Name: 2,4-dinitro-N3,5-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine CAS Name: 2,4-dinitro-N3,5-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine IUPAC Name: 2,4-dinitro-3-N,5-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine Traditional Name: [3-amino-2,6-dinitro-5-propyl-4-(trifluoromethyl)phenyl]-propyl-amine Formula: C13H17F3N4O4 MolecularWeight: 350.29369

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1[N+](=O)[O-])NCCC)[N+](=O)[O-])N)C(F)(F)F

Isomeric SMILES

CCCC1=C(C(=C(C(=C1[N+](=O)[O-])NCCC)[N+](=O)[O-])N)C(F)(F)F

InChI

InChI=1S/C13H17F3N4O4/c1-3-5-7-8(13(14,15)16)9(17)12(20(23)24)10(18-6-4-2)11(7)19(21)22/h18H,3-6,17H2,1-2H3