3-methyl-4-nitro-N-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)-5-(trifluoromethyl)aniline

Systemtic Name: 3-methyl-4-nitro-N-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)-5-(trifluoromethyl)aniline Openeye Name: 3-methyl-4-nitro-N-(2-pyridylmethyl)-N-(3-pyridylmethyl)-5-(trifluoromethyl)aniline CAS Name: 3-methyl-4-nitro-N-(2-pyridinylmethyl)-N-(3-pyridinylmethyl)-5-(trifluoromethyl)aniline IUPAC Name: 3-methyl-4-nitro-N-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)-5-(trifluoromethyl)aniline Traditional Name: [3-methyl-4-nitro-5-(trifluoromethyl)phenyl]-(2-pyridylmethyl)-(3-pyridylmethyl)amine Formula: C20H17F3N4O2 MolecularWeight: 402.36979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])C(F)(F)F)N(CC2=CN=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])C(F)(F)F)N(CC2=CN=CC=C2)CC3=CC=CC=N3

InChI

InChI=1S/C20H17F3N4O2/c1-14-9-17(10-18(20(21,22)23)19(14)27(28)29)26(12-15-5-4-7-24-11-15)13-16-6-2-3-8-25-16/h2-11H,12-13H2,1H3