5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-nitro-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 5-nitro-2-[4-(phenylmethyl)-1-piperidinyl]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-nitro-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 2-(4-benzylpiperidino)-5-nitro-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C26H24F3N3O3 MolecularWeight: 483.48227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H24F3N3O3/c27-26(28,29)20-7-4-8-21(16-20)30-25(33)23-17-22(32(34)35)9-10-24(23)31-13-11-19(12-14-31)15-18-5-2-1-3-6-18/h1-10,16-17,19H,11-15H2,(H,30,33)