4-butoxy-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide

Systemtic Name: 4-butoxy-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide Openeye Name: 4-butoxy-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide CAS Name: 4-butoxy-N-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-pentylbenzamide IUPAC Name: 4-butoxy-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-4-butoxy-N-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C28H35FN2O2 MolecularWeight: 450.588103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C28H35FN2O2/c1-3-5-7-18-31(28(32)24-12-16-27(17-13-24)33-20-6-4-2)22-26-9-8-19-30(26)21-23-10-14-25(29)15-11-23/h8-17,19H,3-7,18,20-22H2,1-2H3