N-(4-chloranyl-2-nitro-phenyl)-2-(1,5-dimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-(1,5-dimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-(1,5-dimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-(1,5-dimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-(1,5-dimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-(1,5-dimethylpyrazol-4-yl)cinchoninamide Formula: C21H16ClN5O3 MolecularWeight: 421.83644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN5O3/c1-12-16(11-23-26(12)2)19-10-15(14-5-3-4-6-17(14)24-19)21(28)25-18-8-7-13(22)9-20(18)27(29)30/h3-11H,1-2H3,(H,25,28)