N-[(4-nitrophenyl)methyl]-4-(trifluoromethyl)aniline; 1H-1,2,4-triazole

Systemtic Name: N-[(4-nitrophenyl)methyl]-4-(trifluoromethyl)aniline; 1H-1,2,4-triazole Openeye Name: N-[(4-nitrophenyl)methyl]-4-(trifluoromethyl)aniline; 1H-1,2,4-triazole CAS Name: N-[(4-nitrophenyl)methyl]-4-(trifluoromethyl)aniline; 1H-1,2,4-triazole IUPAC Name: N-[(4-nitrophenyl)methyl]-4-(trifluoromethyl)aniline; 1H-1,2,4-triazole Traditional Name: (4-nitrobenzyl)-[4-(trifluoromethyl)phenyl]amine; 1H-1,2,4-triazole Formula: C16H14F3N5O2 MolecularWeight: 365.30987

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-].C1=NC=NN1

Isomeric SMILES

C1=CC(=CC=C1CNC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-].C1=NC=NN1

InChI

InChI=1S/C14H11F3N2O2.C2H3N3/c15-14(16,17)11-3-5-12(6-4-11)18-9-10-1-7-13(8-2-10)19(20)21;1-3-2-5-4-1/h1-8,18H,9H2;1-2H,(H,3,4,5)