N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N,4-dipentyl-benzamide

Systemtic Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N,4-dipentyl-benzamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N,4-dipentyl-benzamide CAS Name: N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N,4-dipentylbenzamide IUPAC Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N,4-dipentylbenzamide Traditional Name: N,4-diamyl-N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C29H37ClN2O MolecularWeight: 465.06988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCCCC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCCCC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C29H37ClN2O/c1-3-5-7-11-24-15-17-26(18-16-24)29(33)32(19-8-6-4-2)23-28-14-10-20-31(28)22-25-12-9-13-27(30)21-25/h9-10,12-18,20-21H,3-8,11,19,22-23H2,1-2H3