2-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)ethanoic acid Openeye Name: 2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)acetic acid CAS Name: 2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)acetic acid IUPAC Name: 2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)acetic acid Traditional Name: 2-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)acetic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3/c1-8-10(7-11(15)16)12(17)14(13-8)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,15,16)