N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-4-piperidyl]-2-(4-pyridyl)cinchoninamide Formula: C27H25ClN4O MolecularWeight: 456.9666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H25ClN4O/c28-21-7-5-19(6-8-21)18-32-15-11-22(12-16-32)30-27(33)24-17-26(20-9-13-29-14-10-20)31-25-4-2-1-3-23(24)25/h1-10,13-14,17,22H,11-12,15-16,18H2,(H,30,33)