2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(4-methyl-2-nitro-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(4-methyl-2-nitro-phenyl)quinoline-4-carboxamide Openeye Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(4-methyl-2-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(1-ethyl-5-methyl-4-pyrazolyl)-N-(4-methyl-2-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1-ethyl-5-methylpyrazol-4-yl)-N-(4-methyl-2-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(4-methyl-2-nitro-phenyl)cinchoninamide Formula: C23H21N5O3 MolecularWeight: 415.44454

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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=C(C=C4)C)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O3/c1-4-27-15(3)18(13-24-27)21-12-17(16-7-5-6-8-19(16)25-21)23(29)26-20-10-9-14(2)11-22(20)28(30)31/h5-13H,4H2,1-3H3,(H,26,29)