3-[2-oxidanyl-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-oxidanyl-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[2-hydroxy-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[2-hydroxy-4-(1-pyrazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[2-hydroxy-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[2-hydroxy-4-(pyrazol-1-ylmethyl)phenyl]propionic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC(=C(C=C2)CCC(=O)O)O

Isomeric SMILES

C1=CN(N=C1)CC2=CC(=C(C=C2)CCC(=O)O)O

InChI

InChI=1S/C13H14N2O3/c16-12-8-10(9-15-7-1-6-14-15)2-3-11(12)4-5-13(17)18/h1-3,6-8,16H,4-5,9H2,(H,17,18)