6-bromanyl-N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-(4-chloro-2,5-dimethoxy-phenyl)-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-(4-chloro-2,5-dimethoxyphenyl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(4-chloro-2,5-dimethoxyphenyl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-(4-chloro-2,5-dimethoxy-phenyl)-2-(4-pyridyl)cinchoninamide Formula: C23H17BrClN3O3 MolecularWeight: 498.75638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4)OC)Cl

InChI

InChI=1S/C23H17BrClN3O3/c1-30-21-12-20(22(31-2)11-17(21)25)28-23(29)16-10-19(13-5-7-26-8-6-13)27-18-4-3-14(24)9-15(16)18/h3-12H,1-2H3,(H,28,29)