N-[4-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-4-pentyl-benzamide

Systemtic Name: N-[4-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-4-pentyl-benzamide Openeye Name: N-[4-[4-[2-(o-tolyl)acetyl]piperazin-1-yl]phenyl]-4-pentyl-benzamide CAS Name: N-[4-[4-[2-(2-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-4-pentylbenzamide IUPAC Name: N-[4-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]phenyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[4-[4-[2-(o-tolyl)acetyl]piperazino]phenyl]benzamide Formula: C31H37N3O2 MolecularWeight: 483.64438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CC=C4C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CC=C4C

InChI

InChI=1S/C31H37N3O2/c1-3-4-5-9-25-11-13-26(14-12-25)31(36)32-28-15-17-29(18-16-28)33-19-21-34(22-20-33)30(35)23-27-10-7-6-8-24(27)2/h6-8,10-18H,3-5,9,19-23H2,1-2H3,(H,32,36)