4-nitro-N-(pyridin-4-ylmethyl)-3-(trifluoromethyl)aniline

Systemtic Name: 4-nitro-N-(pyridin-4-ylmethyl)-3-(trifluoromethyl)aniline Openeye Name: 4-nitro-N-(4-pyridylmethyl)-3-(trifluoromethyl)aniline CAS Name: 4-nitro-N-(pyridin-4-ylmethyl)-3-(trifluoromethyl)aniline IUPAC Name: 4-nitro-N-(pyridin-4-ylmethyl)-3-(trifluoromethyl)aniline Traditional Name: [4-nitro-3-(trifluoromethyl)phenyl]-(4-pyridylmethyl)amine Formula: C13H10F3N3O2 MolecularWeight: 297.23261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=CC=NC=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NCC2=CC=NC=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H10F3N3O2/c14-13(15,16)11-7-10(1-2-12(11)19(20)21)18-8-9-3-5-17-6-4-9/h1-7,18H,8H2