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

Systemtic Name: 3-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]propan-1-ol Openeye Name: 3-[2,6-dinitro-4-(trifluoromethyl)anilino]propan-1-ol CAS Name: 3-[2,6-dinitro-4-(trifluoromethyl)anilino]-1-propanol IUPAC Name: 3-[2,6-dinitro-4-(trifluoromethyl)anilino]propan-1-ol Traditional Name: 3-[2,6-dinitro-4-(trifluoromethyl)anilino]propan-1-ol Formula: C10H10F3N3O5 MolecularWeight: 309.19871

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10F3N3O5/c11-10(12,13)6-4-7(15(18)19)9(14-2-1-3-17)8(5-6)16(20)21/h4-5,14,17H,1-3H2