3-oxidanylidene-3-(3-pyrazol-1-ylphenyl)propanoic acid

Systemtic Name: 3-oxidanylidene-3-(3-pyrazol-1-ylphenyl)propanoic acid Openeye Name: 3-oxo-3-(3-pyrazol-1-ylphenyl)propanoic acid CAS Name: 3-oxo-3-[3-(1-pyrazolyl)phenyl]propanoic acid IUPAC Name: 3-oxo-3-(3-pyrazol-1-ylphenyl)propanoic acid Traditional Name: 3-keto-3-(3-pyrazol-1-ylphenyl)propionic acid Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=CC=N2)C(=O)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C=CC=N2)C(=O)CC(=O)O

InChI

InChI=1S/C12H10N2O3/c15-11(8-12(16)17)9-3-1-4-10(7-9)14-6-2-5-13-14/h1-7H,8H2,(H,16,17)