N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]quinoline-8-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]quinoline-8-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]quinoline-8-carboxamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-8-quinolinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]quinoline-8-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]quinoline-8-carboxamide Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H26N4O/c32-27(25-10-4-8-22-9-5-15-28-26(22)25)29-23-11-13-24(14-12-23)31-18-16-30(17-19-31)20-21-6-2-1-3-7-21/h1-15H,16-20H2,(H,29,32)