N-[(3-bromophenyl)methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-benzamide

Systemtic Name: N-[(3-bromophenyl)methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-benzamide Openeye Name: N-[(3-bromophenyl)methyl]-N-(1-isopentyl-4-piperidyl)-4-pentyl-benzamide CAS Name: N-[(3-bromophenyl)methyl]-N-[1-(3-methylbutyl)-4-piperidinyl]-4-pentylbenzamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylbenzamide Traditional Name: 4-amyl-N-(3-bromobenzyl)-N-(1-isoamyl-4-piperidyl)benzamide Formula: C29H41BrN2O MolecularWeight: 513.55264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)Br)C3CCN(CC3)CCC(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)Br)C3CCN(CC3)CCC(C)C

InChI

InChI=1S/C29H41BrN2O/c1-4-5-6-8-24-11-13-26(14-12-24)29(33)32(22-25-9-7-10-27(30)21-25)28-16-19-31(20-17-28)18-15-23(2)3/h7,9-14,21,23,28H,4-6,8,15-20,22H2,1-3H3