N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(3-pyridyl)cinchoninamide Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H22N4O5/c1-33-23-12-16(22(29(31)32)14-24(23)34-2)9-11-27-25(30)19-13-21(17-6-5-10-26-15-17)28-20-8-4-3-7-18(19)20/h3-8,10,12-15H,9,11H2,1-2H3,(H,27,30)