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

Systemtic Name: 3-butoxy-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 3-butoxy-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-butoxy-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-butoxy-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-butoxy-N-[4-(4-o-toluoylpiperazino)phenyl]benzamide Formula: C29H33N3O3 MolecularWeight: 471.59062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C29H33N3O3/c1-3-4-20-35-26-10-7-9-23(21-26)28(33)30-24-12-14-25(15-13-24)31-16-18-32(19-17-31)29(34)27-11-6-5-8-22(27)2/h5-15,21H,3-4,16-20H2,1-2H3,(H,30,33)