2-[4-(pyrazol-1-ylmethyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]ethanoic acid Openeye Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]acetic acid CAS Name: 2-[4-(1-pyrazolylmethyl)phenyl]acetic acid IUPAC Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]acetic acid Traditional Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]acetic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O2/c15-12(16)8-10-2-4-11(5-3-10)9-14-7-1-6-13-14/h1-7H,8-9H2,(H,15,16)