N-[1-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-nitro-pyrazol-3-yl]ethanamide

Systemtic Name: N-[1-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-nitro-pyrazol-3-yl]ethanamide Openeye Name: N-[1-[2-chloro-4-(trifluoromethyl)phenyl]-4-nitro-pyrazol-3-yl]acetamide CAS Name: N-[1-[2-chloro-4-(trifluoromethyl)phenyl]-4-nitro-3-pyrazolyl]acetamide IUPAC Name: N-[1-[2-chloro-4-(trifluoromethyl)phenyl]-4-nitropyrazol-3-yl]acetamide Traditional Name: N-[1-[2-chloro-4-(trifluoromethyl)phenyl]-4-nitro-pyrazol-3-yl]acetamide Formula: C12H8ClF3N4O3 MolecularWeight: 348.66513

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN(C=C1[N+](=O)[O-])C2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

CC(=O)NC1=NN(C=C1[N+](=O)[O-])C2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C12H8ClF3N4O3/c1-6(21)17-11-10(20(22)23)5-19(18-11)9-3-2-7(4-8(9)13)12(14,15)16/h2-5H,1H3,(H,17,18,21)