2-(1,5-dimethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide Openeye Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]quinoline-4-carboxamide CAS Name: 2-(1,5-dimethyl-4-pyrazolyl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]quinoline-4-carboxamide Traditional Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]cinchoninamide Formula: C28H23N5O4 MolecularWeight: 493.51332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(N(N=C5)C)C

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(N(N=C5)C)C

InChI

InChI=1S/C28H23N5O4/c1-17-8-4-7-11-27(17)37-21-13-19(12-20(14-21)33(35)36)30-28(34)23-15-26(24-16-29-32(3)18(24)2)31-25-10-6-5-9-22(23)25/h4-16H,1-3H3,(H,30,34)