2-[3-cyano-4-(3-methylpyrazol-1-yl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-[3-cyano-4-(3-methylpyrazol-1-yl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid Openeye Name: 2-[3-cyano-4-(3-methylpyrazol-1-yl)phenyl]-5-hydroxy-pyridine-4-carboxylic acid CAS Name: 2-[3-cyano-4-(3-methyl-1-pyrazolyl)phenyl]-5-hydroxy-4-pyridinecarboxylic acid IUPAC Name: 2-[3-cyano-4-(3-methylpyrazol-1-yl)phenyl]-5-hydroxypyridine-4-carboxylic acid Traditional Name: 2-[3-cyano-4-(3-methylpyrazol-1-yl)phenyl]-5-hydroxy-isonicotinic acid Formula: C17H12N4O3 MolecularWeight: 320.30218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)C2=C(C=C(C=C2)C3=NC=C(C(=C3)C(=O)O)O)C#N

Isomeric SMILES

CC1=NN(C=C1)C2=C(C=C(C=C2)C3=NC=C(C(=C3)C(=O)O)O)C#N

InChI

InChI=1S/C17H12N4O3/c1-10-4-5-21(20-10)15-3-2-11(6-12(15)8-18)14-7-13(17(23)24)16(22)9-19-14/h2-7,9,22H,1H3,(H,23,24)