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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCC(=O)O

Isomeric SMILES

CC1=NN(C=C1Br)CCC(=O)O

InChI

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