4,4-bis(fluoranyl)-4-(1-methylpyrazol-4-yl)butanoate

Systemtic Name: 4,4-bis(fluoranyl)-4-(1-methylpyrazol-4-yl)butanoate Openeye Name: 4,4-difluoro-4-(1-methylpyrazol-4-yl)butanoate CAS Name: 4,4-difluoro-4-(1-methyl-4-pyrazolyl)butanoate IUPAC Name: 4,4-difluoro-4-(1-methylpyrazol-4-yl)butanoate Traditional Name: 4,4-difluoro-4-(1-methylpyrazol-4-yl)butyrate Formula: C8H9F2N2O2- MolecularWeight: 203.166066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(CCC(=O)[O-])(F)F

Isomeric SMILES

CN1C=C(C=N1)C(CCC(=O)[O-])(F)F

InChI

InChI=1S/C8H10F2N2O2/c1-12-5-6(4-11-12)8(9,10)3-2-7(13)14/h4-5H,2-3H2,1H3,(H,13,14)/p-1