N-(4-methyl-3,5-dinitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C21H16N6O5 MolecularWeight: 432.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C21H16N6O5/c1-12-19(26(29)30)7-14(8-20(12)27(31)32)23-21(28)16-9-18(13-10-22-25(2)11-13)24-17-6-4-3-5-15(16)17/h3-11H,1-2H3,(H,23,28)