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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-homoveratryl-2-(4-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=CC=NC=C4)OC

Isomeric SMILES

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

InChI

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