1-[1-[3-azanyl-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]propan-2-ol

Systemtic Name: 1-[1-[3-azanyl-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]propan-2-ol Openeye Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]propan-2-ol CAS Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]-2-propanol IUPAC Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]propan-2-ol Traditional Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]ethylamino]propan-2-ol Formula: C12H15F3N4O5 MolecularWeight: 352.26651

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15F3N4O5/c1-5(20)4-17-6(2)9-8(18(21)22)3-7(12(13,14)15)10(16)11(9)19(23)24/h3,5-6,17,20H,4,16H2,1-2H3