1-(4-cyanophenyl)-2-methyl-5-oxidanylidene-3-(4-pyridin-2-ylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-2-methyl-5-oxidanylidene-3-(4-pyridin-2-ylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-2-methyl-5-oxo-3-[4-(2-pyridyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-2-methyl-5-oxo-3-[4-(2-pyridinyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-2-methyl-5-oxo-3-(4-pyridin-2-ylphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-5-keto-2-methyl-3-[4-(2-pyridyl)phenyl]-3-pyrazoline-4-carboxylic acid Formula: C23H16N4O3 MolecularWeight: 396.39814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=C(C=C2)C#N)C(=O)O)C3=CC=C(C=C3)C4=CC=CC=N4

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=C(C=C2)C#N)C(=O)O)C3=CC=C(C=C3)C4=CC=CC=N4

InChI

InChI=1S/C23H16N4O3/c1-26-21(17-9-7-16(8-10-17)19-4-2-3-13-25-19)20(23(29)30)22(28)27(26)18-11-5-15(14-24)6-12-18/h2-13H,1H3,(H,29,30)