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

Systemtic Name: [2-methyl-2-[[3-nitro-5-(trifluoromethyl)pyridin-2-yl]amino]propyl] ethanoate Openeye Name: [2-methyl-2-[[3-nitro-5-(trifluoromethyl)-2-pyridyl]amino]propyl] acetate CAS Name: acetic acid [2-methyl-2-[[3-nitro-5-(trifluoromethyl)-2-pyridinyl]amino]propyl] ester IUPAC Name: [2-methyl-2-[[3-nitro-5-(trifluoromethyl)pyridin-2-yl]amino]propyl] acetate Traditional Name: acetic acid [2-methyl-2-[[3-nitro-5-(trifluoromethyl)-2-pyridyl]amino]propyl] ester Formula: C12H14F3N3O4 MolecularWeight: 321.25247

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14F3N3O4/c1-7(19)22-6-11(2,3)17-10-9(18(20)21)4-8(5-16-10)12(13,14)15/h4-5H,6H2,1-3H3,(H,16,17)