3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propane-1,1-diol

Systemtic Name: 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propane-1,1-diol Openeye Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,1-diol CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,1-diol IUPAC Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,1-diol Traditional Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,1-diol Formula: C10H11F3N2O4 MolecularWeight: 280.20055

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCC(O)O

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCC(O)O

InChI

InChI=1S/C10H11F3N2O4/c11-10(12,13)6-1-2-7(8(5-6)15(18)19)14-4-3-9(16)17/h1-2,5,9,14,16-17H,3-4H2