N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]quinoline-8-carboxamide

Systemtic Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]quinoline-8-carboxamide Openeye Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]quinoline-8-carboxamide CAS Name: N-[[3-[3-(1-piperazinylmethyl)phenyl]phenyl]methyl]-8-quinolinecarboxamide IUPAC Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]quinoline-8-carboxamide Traditional Name: N-[3-[3-(piperazinomethyl)phenyl]benzyl]quinoline-8-carboxamide Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C28H28N4O/c33-28(26-11-3-7-23-10-4-12-30-27(23)26)31-19-21-5-1-8-24(17-21)25-9-2-6-22(18-25)20-32-15-13-29-14-16-32/h1-12,17-18,29H,13-16,19-20H2,(H,31,33)