N-(4-ethoxy-2-nitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O4/c1-3-31-15-8-9-19(21(10-15)27(29)30)25-22(28)17-11-20(14-12-23-26(2)13-14)24-18-7-5-4-6-16(17)18/h4-13H,3H2,1-2H3,(H,25,28)