N-[(1-methylpyrazol-4-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[(1-methylpyrazol-4-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(1-methylpyrazol-4-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: (1-methylpyrazol-4-yl)methyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C12H11F3N4O2 MolecularWeight: 300.23655

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H11F3N4O2/c1-18-7-8(6-17-18)5-16-10-3-2-9(12(13,14)15)4-11(10)19(20)21/h2-4,6-7,16H,5H2,1H3