2-(1-ethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(1-ethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide Openeye Name: 2-(1-ethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide CAS Name: 2-(1-ethyl-4-pyrazolyl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]-4-quinolinecarboxamide IUPAC Name: 2-(1-ethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]quinoline-4-carboxamide Traditional Name: 2-(1-ethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]cinchoninamide Formula: C28H23N5O4 MolecularWeight: 493.51332

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)OC5=CC=CC=C5C)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)OC5=CC=CC=C5C)[N+](=O)[O-]

InChI

InChI=1S/C28H23N5O4/c1-3-32-17-19(16-29-32)26-15-24(23-9-5-6-10-25(23)31-26)28(34)30-20-12-21(33(35)36)14-22(13-20)37-27-11-7-4-8-18(27)2/h4-17H,3H2,1-2H3,(H,30,34)