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

Systemtic Name: N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-4-pentyl-benzamide Openeye Name: N-(1-isopentyl-4-piperidyl)-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-4-pentyl-benzamide CAS Name: N-[1-(3-methylbutyl)-4-piperidinyl]-N-[[4-(4-methyl-1-piperazinyl)phenyl]methyl]-4-pentylbenzamide IUPAC Name: N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-(1-isoamyl-4-piperidyl)-N-[4-(4-methylpiperazino)benzyl]benzamide Formula: C34H52N4O MolecularWeight: 532.80288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N3CCN(CC3)C)C4CCN(CC4)CCC(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N3CCN(CC3)C)C4CCN(CC4)CCC(C)C

InChI

InChI=1S/C34H52N4O/c1-5-6-7-8-29-9-13-31(14-10-29)34(39)38(33-18-21-36(22-19-33)20-17-28(2)3)27-30-11-15-32(16-12-30)37-25-23-35(4)24-26-37/h9-16,28,33H,5-8,17-27H2,1-4H3