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

Systemtic Name: 4-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide Openeye Name: 4-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide CAS Name: 4-butyl-N-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-pentylbenzamide IUPAC Name: 4-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-4-butyl-N-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C28H35FN2O MolecularWeight: 434.588703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35FN2O/c1-3-5-7-19-31(28(32)25-15-11-23(12-16-25)9-6-4-2)22-27-10-8-20-30(27)21-24-13-17-26(29)18-14-24/h8,10-18,20H,3-7,9,19,21-22H2,1-2H3