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

Systemtic Name: 3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)propanoic acid Openeye Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)propanoic acid CAS Name: 3-(5-chloro-1,3-dimethyl-4-pyrazolyl)propanoic acid IUPAC Name: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)propanoic acid Traditional Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)propionic acid Formula: C8H11ClN2O2 MolecularWeight: 202.63814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCC(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CCC(=O)O)Cl)C

InChI

InChI=1S/C8H11ClN2O2/c1-5-6(3-4-7(12)13)8(9)11(2)10-5/h3-4H2,1-2H3,(H,12,13)