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

Systemtic Name: N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-4-propoxy-benzamide Openeye Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-4-propoxy-benzamide CAS Name: N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-propoxybenzamide IUPAC Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-4-propoxybenzamide Traditional Name: 4-propoxy-N-[4-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H31N3O3/c1-3-20-34-26-14-8-22(9-15-26)27(32)29-24-10-12-25(13-11-24)30-16-18-31(19-17-30)28(33)23-6-4-21(2)5-7-23/h4-15H,3,16-20H2,1-2H3,(H,29,32)