[6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-3-nitro-pyridin-2-yl] 2-azanylpropanoate

Systemtic Name: [6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-3-nitro-pyridin-2-yl] 2-azanylpropanoate Openeye Name: [6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-3-nitro-2-pyridyl] 2-aminopropanoate CAS Name: 2-aminopropanoic acid [6-[[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]-3-nitro-2-pyridinyl] ester IUPAC Name: [6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-3-nitropyridin-2-yl] 2-aminopropanoate Traditional Name: 2-aminopropionic acid [6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-3-nitro-2-pyridyl] ester Formula: C13H12F3N5O5 MolecularWeight: 375.26009

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=C(C=CC(=N1)OC2=NN(C(=C2)C(F)(F)F)C)[N+](=O)[O-])N

Isomeric SMILES

CC(C(=O)OC1=C(C=CC(=N1)OC2=NN(C(=C2)C(F)(F)F)C)[N+](=O)[O-])N

InChI

InChI=1S/C13H12F3N5O5/c1-6(17)12(22)26-11-7(21(23)24)3-4-9(18-11)25-10-5-8(13(14,15)16)20(2)19-10/h3-6H,17H2,1-2H3