3-bromanyl-4-nitro-N,N-bis(pyridin-2-ylmethyl)-5-(trifluoromethyl)aniline

Systemtic Name: 3-bromanyl-4-nitro-N,N-bis(pyridin-2-ylmethyl)-5-(trifluoromethyl)aniline Openeye Name: 3-bromo-4-nitro-N,N-bis(2-pyridylmethyl)-5-(trifluoromethyl)aniline CAS Name: 3-bromo-4-nitro-N,N-bis(2-pyridinylmethyl)-5-(trifluoromethyl)aniline IUPAC Name: 3-bromo-4-nitro-N,N-bis(pyridin-2-ylmethyl)-5-(trifluoromethyl)aniline Traditional Name: [3-bromo-4-nitro-5-(trifluoromethyl)phenyl]-bis(2-pyridylmethyl)amine Formula: C19H14BrF3N4O2 MolecularWeight: 467.23927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)C3=CC(=C(C(=C3)C(F)(F)F)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)C3=CC(=C(C(=C3)C(F)(F)F)[N+](=O)[O-])Br

InChI

InChI=1S/C19H14BrF3N4O2/c20-17-10-15(9-16(19(21,22)23)18(17)27(28)29)26(11-13-5-1-3-7-24-13)12-14-6-2-4-8-25-14/h1-10H,11-12H2