8-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: 8-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 8-chloro-N-homoveratryl-2-(2-pyridyl)cinchoninamide Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=CC=N4)OC

InChI

InChI=1S/C25H22ClN3O3/c1-31-22-10-9-16(14-23(22)32-2)11-13-28-25(30)18-15-21(20-8-3-4-12-27-20)29-24-17(18)6-5-7-19(24)26/h3-10,12,14-15H,11,13H2,1-2H3,(H,28,30)