4-(3-ethyl-5-oxidanylidene-4H-pyrazol-1-yl)benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H12N2O3/c1-2-9-7-11(15)14(13-9)10-5-3-8(4-6-10)12(16)17/h3-6H,2,7H2,1H3,(H,16,17)