N-hexyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-hexyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-hexyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-hexyl-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-hexyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-hexyl-2-(4-pyridyl)cinchoninamide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

InChI

InChI=1S/C21H23N3O/c1-2-3-4-7-12-23-21(25)18-15-20(16-10-13-22-14-11-16)24-19-9-6-5-8-17(18)19/h5-6,8-11,13-15H,2-4,7,12H2,1H3,(H,23,25)