6-chloranyl-N-[2-(phenylmethyl)phenyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[2-(phenylmethyl)phenyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(2-benzylphenyl)-6-chloro-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[2-(phenylmethyl)phenyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(2-benzylphenyl)-6-chloro-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(2-benzylphenyl)-6-chloro-2-(3-pyridyl)cinchoninamide Formula: C28H20ClN3O MolecularWeight: 449.9309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

InChI

InChI=1S/C28H20ClN3O/c29-22-12-13-26-23(16-22)24(17-27(31-26)21-10-6-14-30-18-21)28(33)32-25-11-5-4-9-20(25)15-19-7-2-1-3-8-19/h1-14,16-18H,15H2,(H,32,33)