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

Systemtic Name: 5-chloranyl-2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-4-(trifluoromethyl)aniline Openeye Name: 5-chloro-2-nitro-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-4-(trifluoromethyl)aniline CAS Name: 5-chloro-2-nitro-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-4-(trifluoromethyl)aniline IUPAC Name: 5-chloro-2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-4-(trifluoromethyl)aniline Traditional Name: [5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-[(2-pyrazol-1-yl-3-pyridyl)methyl]amine Formula: C16H11ClF3N5O2 MolecularWeight: 397.73905

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClF3N5O2/c17-12-8-13(14(25(26)27)7-11(12)16(18,19)20)22-9-10-3-1-4-21-15(10)24-6-2-5-23-24/h1-8,22H,9H2