2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)ethanoic acid

Systemtic Name: 2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)ethanoic acid Openeye Name: 2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acetic acid CAS Name: 2-(5-chloro-1,3-dimethyl-4-pyrazolyl)acetic acid IUPAC Name: 2-(5-chloro-1,3-dimethylpyrazol-4-yl)acetic acid Traditional Name: 2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acetic acid Formula: C7H9ClN2O2 MolecularWeight: 188.61156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CC(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CC(=O)O)Cl)C

InChI

InChI=1S/C7H9ClN2O2/c1-4-5(3-6(11)12)7(8)10(2)9-4/h3H2,1-2H3,(H,11,12)