3-(4-bromanyl-1-methyl-pyrazol-3-yl)propanoic acid

Systemtic Name: 3-(4-bromanyl-1-methyl-pyrazol-3-yl)propanoic acid Openeye Name: 3-(4-bromo-1-methyl-pyrazol-3-yl)propanoic acid CAS Name: 3-(4-bromo-1-methyl-3-pyrazolyl)propanoic acid IUPAC Name: 3-(4-bromo-1-methylpyrazol-3-yl)propanoic acid Traditional Name: 3-(4-bromo-1-methyl-pyrazol-3-yl)propionic acid Formula: C7H9BrN2O2 MolecularWeight: 233.06256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)CCC(=O)O)Br

Isomeric SMILES

CN1C=C(C(=N1)CCC(=O)O)Br

InChI

InChI=1S/C7H9BrN2O2/c1-10-4-5(8)6(9-10)2-3-7(11)12/h4H,2-3H2,1H3,(H,11,12)