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

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C23H20N6O5 MolecularWeight: 460.4421

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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=C(N(N=C4C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H20N6O5/c1-12-20(28(31)32)9-15(10-21(12)29(33)34)24-23(30)17-11-19(22-13(2)26-27(4)14(22)3)25-18-8-6-5-7-16(17)18/h5-11H,1-4H3,(H,24,30)