2-[[3-nitro-5-(trifluoromethyl)pyridin-2-yl]amino]propyl ethanoate

Systemtic Name: 2-[[3-nitro-5-(trifluoromethyl)pyridin-2-yl]amino]propyl ethanoate Openeye Name: 2-[[3-nitro-5-(trifluoromethyl)-2-pyridyl]amino]propyl acetate CAS Name: acetic acid 2-[[3-nitro-5-(trifluoromethyl)-2-pyridinyl]amino]propyl ester IUPAC Name: 2-[[3-nitro-5-(trifluoromethyl)pyridin-2-yl]amino]propyl acetate Traditional Name: acetic acid 2-[[3-nitro-5-(trifluoromethyl)-2-pyridyl]amino]propyl ester Formula: C11H12F3N3O4 MolecularWeight: 307.22589

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C)NC1=C(C=C(C=N1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(COC(=O)C)NC1=C(C=C(C=N1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H12F3N3O4/c1-6(5-21-7(2)18)16-10-9(17(19)20)3-8(4-15-10)11(12,13)14/h3-4,6H,5H2,1-2H3,(H,15,16)