N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-pentyl-N-(phenylmethyl)benzamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-pentyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-pentyl-benzamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-4-pentyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-benzyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C31H33FN2O MolecularWeight: 468.604923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CN3CC4=CC(=CC=C4)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CN3CC4=CC(=CC=C4)F

InChI

InChI=1S/C31H33FN2O/c1-2-3-5-10-25-16-18-28(19-17-25)31(35)34(22-26-11-6-4-7-12-26)24-30-15-9-20-33(30)23-27-13-8-14-29(32)21-27/h4,6-9,11-21H,2-3,5,10,22-24H2,1H3