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

Systemtic Name: 1-[1-[3-azanyl-2,6-dinitro-4-(trifluoromethyl)phenyl]propylamino]propan-2-ol Openeye Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]propylamino]propan-2-ol CAS Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]propylamino]-2-propanol IUPAC Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]propylamino]propan-2-ol Traditional Name: 1-[1-[3-amino-2,6-dinitro-4-(trifluoromethyl)phenyl]propylamino]propan-2-ol Formula: C13H17F3N4O5 MolecularWeight: 366.29309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17F3N4O5/c1-3-8(18-5-6(2)21)10-9(19(22)23)4-7(13(14,15)16)11(17)12(10)20(24)25/h4,6,8,18,21H,3,5,17H2,1-2H3