N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-pyridyl)cinchoninamide Formula: C23H15BrN4O3 MolecularWeight: 475.2942

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5)Br

InChI

InChI=1S/C23H15BrN4O3/c24-18-11-22-21(30-13-31-22)9-15(18)12-26-28-23(29)17-10-20(14-5-7-25-8-6-14)27-19-4-2-1-3-16(17)19/h1-12H,13H2,(H,28,29)/b26-12+