N3-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]benzene-1,3-dicarboxamide

Systemtic Name: N3-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]benzene-1,3-dicarboxamide Openeye Name: N3-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]benzene-1,3-dicarboxamide CAS Name: N3-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]benzene-1,3-dicarboxamide IUPAC Name: 3-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]benzene-1,3-dicarboxamide Traditional Name: N'-[2-[(4-phenylpiperazino)methyl]benzyl]isophthalamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=CC=CC(=C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=CC=CC(=C3)C(=O)N)C4=CC=CC=C4

InChI

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