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

Systemtic Name: 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propane-1,2-diol Openeye Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,2-diol CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,2-diol IUPAC Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,2-diol Traditional Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propane-1,2-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-])NCC(CO)O

Isomeric SMILES

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

InChI

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