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

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(3-methoxypropyl)-4-pentyl-benzamide Openeye Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(3-methoxypropyl)-4-pentyl-benzamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-(3-methoxypropyl)-4-pentylbenzamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(3-methoxypropyl)-4-pentylbenzamide Traditional Name: 4-amyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-N-(3-methoxypropyl)benzamide Formula: C28H35FN2O2 MolecularWeight: 450.588103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC(=CC=C3)F

InChI

InChI=1S/C28H35FN2O2/c1-3-4-5-9-23-13-15-25(16-14-23)28(32)31(18-8-19-33-2)22-27-12-7-17-30(27)21-24-10-6-11-26(29)20-24/h6-7,10-17,20H,3-5,8-9,18-19,21-22H2,1-2H3