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

Systemtic Name: 4-butyl-N-[4-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]benzamide Openeye Name: 4-butyl-N-[4-[4-[2-(o-tolyl)acetyl]piperazin-1-yl]phenyl]benzamide CAS Name: 4-butyl-N-[4-[4-[2-(2-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-butyl-N-[4-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]phenyl]benzamide Traditional Name: 4-butyl-N-[4-[4-[2-(o-tolyl)acetyl]piperazino]phenyl]benzamide Formula: C30H35N3O2 MolecularWeight: 469.6178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CC=C4C

InChI

InChI=1S/C30H35N3O2/c1-3-4-8-24-10-12-25(13-11-24)30(35)31-27-14-16-28(17-15-27)32-18-20-33(21-19-32)29(34)22-26-9-6-5-7-23(26)2/h5-7,9-17H,3-4,8,18-22H2,1-2H3,(H,31,35)