N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)octanamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)octanamide Openeye Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]octanamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-(phenylmethyl)octanamide IUPAC Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]octanamide Traditional Name: N-benzyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]caprylamide Formula: C27H33FN2O MolecularWeight: 420.562123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCCCC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC(=CC=C3)F

InChI

InChI=1S/C27H33FN2O/c1-2-3-4-5-9-17-27(31)30(20-23-12-7-6-8-13-23)22-26-16-11-18-29(26)21-24-14-10-15-25(28)19-24/h6-8,10-16,18-19H,2-5,9,17,20-22H2,1H3