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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(3-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(3-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(3-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=CN=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CN=CC=C5

InChI

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