4-(4-pyrimidin-4-ylpyrazol-1-yl)benzoic acid

Systemtic Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzoic acid Openeye Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzoic acid CAS Name: 4-[4-(4-pyrimidinyl)-1-pyrazolyl]benzoic acid IUPAC Name: 4-(4-pyrimidin-4-ylpyrazol-1-yl)benzoic acid Traditional Name: 4-[4-(4-pyrimidyl)pyrazol-1-yl]benzoic acid Formula: C14H10N4O2 MolecularWeight: 266.2548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C=C(C=N2)C3=NC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C=C(C=N2)C3=NC=NC=C3

InChI

InChI=1S/C14H10N4O2/c19-14(20)10-1-3-12(4-2-10)18-8-11(7-17-18)13-5-6-15-9-16-13/h1-9H,(H,19,20)