N'-[2,6-dinitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine

Systemtic Name: N'-[2,6-dinitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine Openeye Name: N'-[2,6-dinitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine CAS Name: N'-[2,6-dinitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine IUPAC Name: N'-[2,6-dinitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-[2,6-dinitro-4-(trifluoromethyl)phenyl]amine Formula: C9H9F3N4O4 MolecularWeight: 294.18737

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9F3N4O4/c10-9(11,12)5-3-6(15(17)18)8(14-2-1-13)7(4-5)16(19)20/h3-4,14H,1-2,13H2