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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-homoveratryl-2-(3-pyridyl)cinchoninamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)OC

InChI

InChI=1S/C25H23N3O3/c1-30-23-10-9-17(14-24(23)31-2)11-13-27-25(29)20-15-22(18-6-5-12-26-16-18)28-21-8-4-3-7-19(20)21/h3-10,12,14-16H,11,13H2,1-2H3,(H,27,29)