N-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,6-dimethoxy-benzamide Openeye Name: N-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,6-dimethoxy-benzamide CAS Name: N-butyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-2,6-dimethoxybenzamide IUPAC Name: N-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,6-dimethoxybenzamide Traditional Name: N-butyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-2,6-dimethoxy-benzamide Formula: C25H29FN2O3 MolecularWeight: 424.507763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C25H29FN2O3/c1-4-5-14-28(25(29)24-22(30-2)12-7-13-23(24)31-3)18-21-11-8-15-27(21)17-19-9-6-10-20(26)16-19/h6-13,15-16H,4-5,14,17-18H2,1-3H3