4-oxidanylidene-4-(4-pyrazol-1-ylphenyl)butanoic acid

Systemtic Name: 4-oxidanylidene-4-(4-pyrazol-1-ylphenyl)butanoic acid Openeye Name: 4-oxo-4-(4-pyrazol-1-ylphenyl)butanoic acid CAS Name: 4-oxo-4-[4-(1-pyrazolyl)phenyl]butanoic acid IUPAC Name: 4-oxo-4-(4-pyrazol-1-ylphenyl)butanoic acid Traditional Name: 4-keto-4-(4-pyrazol-1-ylphenyl)butyric acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O3/c16-12(6-7-13(17)18)10-2-4-11(5-3-10)15-9-1-8-14-15/h1-5,8-9H,6-7H2,(H,17,18)