N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-pyridyl)cinchoninamide Formula: C24H19N3O3 MolecularWeight: 397.42596

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5)OC1

InChI

InChI=1S/C24H19N3O3/c28-24(26-16-9-10-22-23(14-16)30-13-5-12-29-22)18-15-21(20-8-3-4-11-25-20)27-19-7-2-1-6-17(18)19/h1-4,6-11,14-15H,5,12-13H2,(H,26,28)