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

Systemtic Name: 2-(1-methylpyrazol-4-yl)-N-(5-nitro-2-oxidanyl-phenyl)quinoline-4-carboxamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C20H15N5O4 MolecularWeight: 389.3642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C20H15N5O4/c1-24-11-12(10-21-24)17-9-15(14-4-2-3-5-16(14)22-17)20(27)23-18-8-13(25(28)29)6-7-19(18)26/h2-11,26H,1H3,(H,23,27)