(2S)-2-[3-[bis(fluoranyl)methyl]-4-bromanyl-5-methyl-pyrazol-1-yl]propanoate

Systemtic Name: (2S)-2-[3-[bis(fluoranyl)methyl]-4-bromanyl-5-methyl-pyrazol-1-yl]propanoate Openeye Name: (2S)-2-[4-bromo-3-(difluoromethyl)-5-methyl-pyrazol-1-yl]propanoate CAS Name: (2S)-2-[4-bromo-3-(difluoromethyl)-5-methyl-1-pyrazolyl]propanoate IUPAC Name: (2S)-2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoate Traditional Name: (2S)-2-[4-bromo-3-(difluoromethyl)-5-methyl-pyrazol-1-yl]propionate Formula: C8H8BrF2N2O2- MolecularWeight: 282.062126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)[O-])C(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1[C@@H](C)C(=O)[O-])C(F)F)Br

InChI

InChI=1S/C8H9BrF2N2O2/c1-3-5(9)6(7(10)11)12-13(3)4(2)8(14)15/h4,7H,1-2H3,(H,14,15)/p-1/t4-/m0/s1