N3-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzene-1,3-dicarboxamide

Systemtic Name: N3-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzene-1,3-dicarboxamide Openeye Name: N3-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzene-1,3-dicarboxamide CAS Name: N3-[[3-[3-(1-piperazinylmethyl)phenyl]phenyl]methyl]benzene-1,3-dicarboxamide IUPAC Name: 3-N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzene-1,3-dicarboxamide Traditional Name: N'-[3-[3-(piperazinomethyl)phenyl]benzyl]isophthalamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C26H28N4O2/c27-25(31)23-8-3-9-24(16-23)26(32)29-17-19-4-1-6-21(14-19)22-7-2-5-20(15-22)18-30-12-10-28-11-13-30/h1-9,14-16,28H,10-13,17-18H2,(H2,27,31)(H,29,32)