(2S)-2-(3,5-dimethylpyrazol-1-yl)-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-(3,5-dimethylpyrazol-1-yl)-2-phenyl-ethanoic acid Openeye Name: (2S)-2-(3,5-dimethylpyrazol-1-yl)-2-phenyl-acetic acid CAS Name: (2S)-2-(3,5-dimethyl-1-pyrazolyl)-2-phenylacetic acid IUPAC Name: (2S)-2-(3,5-dimethylpyrazol-1-yl)-2-phenylacetic acid Traditional Name: (2S)-2-(3,5-dimethylpyrazol-1-yl)-2-phenyl-acetic acid Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1[C@@H](C2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C13H14N2O2/c1-9-8-10(2)15(14-9)12(13(16)17)11-6-4-3-5-7-11/h3-8,12H,1-2H3,(H,16,17)/t12-/m0/s1