ethane; 2-(3-phenylpyrazol-1-yl)ethanoic acid

Systemtic Name: ethane; 2-(3-phenylpyrazol-1-yl)ethanoic acid Openeye Name: ethane; 2-(3-phenylpyrazol-1-yl)acetic acid CAS Name: ethane; 2-(3-phenyl-1-pyrazolyl)acetic acid IUPAC Name: ethane; 2-(3-phenylpyrazol-1-yl)acetic acid Traditional Name: ethane; 2-(3-phenylpyrazol-1-yl)acetic acid Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC.C1=CC=C(C=C1)C2=NN(C=C2)CC(=O)O

Isomeric SMILES

CC.C1=CC=C(C=C1)C2=NN(C=C2)CC(=O)O

InChI

InChI=1S/C11H10N2O2.C2H6/c14-11(15)8-13-7-6-10(12-13)9-4-2-1-3-5-9;1-2/h1-7H,8H2,(H,14,15);1-2H3