2-[3-[1-(5-oxidanylpyridin-2-yl)pyrazol-3-yl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[1-(5-oxidanylpyridin-2-yl)pyrazol-3-yl]propanoylamino]benzoic acid Openeye Name: 2-[3-[1-(5-hydroxy-2-pyridyl)pyrazol-3-yl]propanoylamino]benzoic acid CAS Name: 2-[[3-[1-(5-hydroxy-2-pyridinyl)-3-pyrazolyl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-[1-(5-hydroxypyridin-2-yl)pyrazol-3-yl]propanoylamino]benzoic acid Traditional Name: 2-[3-[1-(5-hydroxy-2-pyridyl)pyrazol-3-yl]propanoylamino]benzoic acid Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=NN(C=C2)C3=NC=C(C=C3)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=NN(C=C2)C3=NC=C(C=C3)O

InChI

InChI=1S/C18H16N4O4/c23-13-6-7-16(19-11-13)22-10-9-12(21-22)5-8-17(24)20-15-4-2-1-3-14(15)18(25)26/h1-4,6-7,9-11,23H,5,8H2,(H,20,24)(H,25,26)