4-(5-oxidanylidene-3-pyridin-3-yl-4H-pyrazol-1-yl)benzoic acid

Systemtic Name: 4-(5-oxidanylidene-3-pyridin-3-yl-4H-pyrazol-1-yl)benzoic acid Openeye Name: 4-[5-oxo-3-(3-pyridyl)-4H-pyrazol-1-yl]benzoic acid CAS Name: 4-[5-oxo-3-(3-pyridinyl)-4H-pyrazol-1-yl]benzoic acid IUPAC Name: 4-(5-oxo-3-pyridin-3-yl-4H-pyrazol-1-yl)benzoic acid Traditional Name: 4-[5-keto-3-(3-pyridyl)-2-pyrazolin-1-yl]benzoic acid Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=C(C=C2)C(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=C(C=C2)C(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C15H11N3O3/c19-14-8-13(11-2-1-7-16-9-11)17-18(14)12-5-3-10(4-6-12)15(20)21/h1-7,9H,8H2,(H,20,21)