2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-4-(trifluoromethyl)aniline

Systemtic Name: 2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-4-(trifluoromethyl)aniline Openeye Name: 2-nitro-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-4-(trifluoromethyl)aniline CAS Name: 2-nitro-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-4-(trifluoromethyl)aniline IUPAC Name: 2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-[(2-pyrazol-1-yl-3-pyridyl)methyl]amine Formula: C16H12F3N5O2 MolecularWeight: 363.29399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N2C=CC=N2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)N2C=CC=N2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H12F3N5O2/c17-16(18,19)12-4-5-13(14(9-12)24(25)26)21-10-11-3-1-6-20-15(11)23-8-2-7-22-23/h1-9,21H,10H2