4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate

Systemtic Name: 4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate Openeye Name: 4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate CAS Name: 4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate IUPAC Name: 4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate Traditional Name: 4-[(1S)-2,2-dicyano-1-(2-fluorophenyl)ethyl]-5-methyl-1H-pyrazol-3-olate Formula: C14H10FN4O- MolecularWeight: 269.253803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)[O-])C(C2=CC=CC=C2F)C(C#N)C#N

Isomeric SMILES

CC1=C(C(=NN1)[O-])[C@@H](C2=CC=CC=C2F)C(C#N)C#N

InChI

InChI=1S/C14H11FN4O/c1-8-12(14(20)19-18-8)13(9(6-16)7-17)10-4-2-3-5-11(10)15/h2-5,9,13H,1H3,(H2,18,19,20)/p-1/t13-/m1/s1