3-nitro-N-pentyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]benzamide

Systemtic Name: 3-nitro-N-pentyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]benzamide Openeye Name: 3-nitro-N-pentyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]benzamide CAS Name: 3-nitro-N-pentyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolyl]methyl]benzamide IUPAC Name: 3-nitro-N-pentyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]benzamide Traditional Name: N-amyl-3-nitro-N-[[1-[3-(trifluoromethyl)benzyl]pyrrol-2-yl]methyl]benzamide Formula: C25H26F3N3O3 MolecularWeight: 473.48745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26F3N3O3/c1-2-3-4-13-30(24(32)20-9-6-11-22(16-20)31(33)34)18-23-12-7-14-29(23)17-19-8-5-10-21(15-19)25(26,27)28/h5-12,14-16H,2-4,13,17-18H2,1H3