3-bromanyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide

Systemtic Name: 3-bromanyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-benzamide Openeye Name: 3-bromo-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-N-pentyl-benzamide CAS Name: 3-bromo-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-pentylbenzamide IUPAC Name: 3-bromo-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-3-bromo-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]benzamide Formula: C25H29BrN2O MolecularWeight: 453.41456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C25H29BrN2O/c1-3-4-7-15-28(25(29)21-12-8-13-23(26)17-21)19-24-14-9-16-27(24)18-22-11-6-5-10-20(22)2/h5-6,8-14,16-17H,3-4,7,15,18-19H2,1-2H3