2-(1-ethylpyrazol-4-yl)-N-(5-nitro-2-oxidanyl-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1-ethylpyrazol-4-yl)-N-(5-nitro-2-oxidanyl-phenyl)quinoline-4-carboxamide Openeye Name: 2-(1-ethylpyrazol-4-yl)-N-(2-hydroxy-5-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(1-ethyl-4-pyrazolyl)-N-(2-hydroxy-5-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1-ethylpyrazol-4-yl)-N-(2-hydroxy-5-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(1-ethylpyrazol-4-yl)-N-(2-hydroxy-5-nitro-phenyl)cinchoninamide Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N5O4/c1-2-25-12-13(11-22-25)18-10-16(15-5-3-4-6-17(15)23-18)21(28)24-19-9-14(26(29)30)7-8-20(19)27/h3-12,27H,2H2,1H3,(H,24,28)