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

Systemtic Name: 4-butyl-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 4-butyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-butyl-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-butyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-butyl-N-[4-(4-o-toluoylpiperazino)phenyl]benzamide Formula: C29H33N3O2 MolecularWeight: 455.59122

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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)C4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C29H33N3O2/c1-3-4-8-23-10-12-24(13-11-23)28(33)30-25-14-16-26(17-15-25)31-18-20-32(21-19-31)29(34)27-9-6-5-7-22(27)2/h5-7,9-17H,3-4,8,18-21H2,1-2H3,(H,30,33)