N-(4-chloranyl-2-nitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C22H18ClN5O3 MolecularWeight: 435.86302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN5O3/c1-12-21(13(2)27(3)26-12)19-11-16(15-6-4-5-7-17(15)24-19)22(29)25-18-9-8-14(23)10-20(18)28(30)31/h4-11H,1-3H3,(H,25,29)