2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitro-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitro-phenyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methoxy-2-nitro-phenyl)cinchoninamide Formula: C24H17N3O6 MolecularWeight: 443.40828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

InChI

InChI=1S/C24H17N3O6/c1-31-15-7-8-19(21(11-15)27(29)30)26-24(28)17-12-20(25-18-5-3-2-4-16(17)18)14-6-9-22-23(10-14)33-13-32-22/h2-12H,13H2,1H3,(H,26,28)