1-(3-nitrophenyl)-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-nitrophenyl)-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid Openeye Name: 1-(3-nitrophenyl)-5-phenyl-4-[(E)-C-phenyl-N-(2-pyridylamino)carbonimidoyl]pyrazole-3-carboxylic acid CAS Name: 1-(3-nitrophenyl)-5-phenyl-4-[(E)-phenyl-(2-pyridinylhydrazinylidene)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-nitrophenyl)-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid Traditional Name: 1-(3-nitrophenyl)-5-phenyl-4-[(E)-C-phenyl-N-(2-pyridylamino)carbonimidoyl]pyrazole-3-carboxylic acid Formula: C28H20N6O4 MolecularWeight: 504.4962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)C(=NNC4=CC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)/C(=N/NC4=CC=CC=N4)/C5=CC=CC=C5

InChI

InChI=1S/C28H20N6O4/c35-28(36)26-24(25(19-10-3-1-4-11-19)31-30-23-16-7-8-17-29-23)27(20-12-5-2-6-13-20)33(32-26)21-14-9-15-22(18-21)34(37)38/h1-18H,(H,29,30)(H,35,36)/b31-25+