2-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2-pyridylmethyl)cinchoninamide Formula: C23H17N3O3 MolecularWeight: 383.39938

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=CC=N5

InChI

InChI=1S/C23H17N3O3/c27-23(25-13-16-5-3-4-10-24-16)18-12-20(26-19-7-2-1-6-17(18)19)15-8-9-21-22(11-15)29-14-28-21/h1-12H,13-14H2,(H,25,27)