2-(3-methyl-5-oxidanylidene-pyrazol-4-yl)propanoic acid

Systemtic Name: 2-(3-methyl-5-oxidanylidene-pyrazol-4-yl)propanoic acid Openeye Name: 2-(3-methyl-5-oxo-pyrazol-4-yl)propanoic acid CAS Name: 2-(3-methyl-5-oxo-4-pyrazolyl)propanoic acid IUPAC Name: 2-(3-methyl-5-oxopyrazol-4-yl)propanoic acid Traditional Name: 2-(3-keto-5-methyl-pyrazol-4-yl)propionic acid Formula: C7H8N2O3 MolecularWeight: 168.15002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=N1)C(C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=N1)C(C)C(=O)O

InChI

InChI=1S/C7H8N2O3/c1-3(7(11)12)5-4(2)8-9-6(5)10/h3H,1-2H3,(H,11,12)