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

Systemtic Name: 4-tert-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide Openeye Name: 4-tert-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide CAS Name: 4-tert-butyl-N-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-pentylbenzamide IUPAC Name: 4-tert-butyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-4-tert-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)C(C)(C)C

Isomeric SMILES

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

InChI

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