4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-5-fluoranyl-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-5-fluoranyl-2-oxidanyl-benzenecarbonitrile Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-5-fluoro-2-hydroxy-benzonitrile CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-5-fluoro-2-hydroxybenzonitrile IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-5-fluoro-2-hydroxybenzonitrile Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-5-fluoro-2-hydroxy-benzonitrile Formula: C12H9FN4O3 MolecularWeight: 276.223263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=C(C=C(C(=C2)O)C#N)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=C(C=C(C(=C2)O)C#N)F)C)[N+](=O)[O-]

InChI

InChI=1S/C12H9FN4O3/c1-6-12(17(19)20)7(2)16(15-6)10-4-11(18)8(5-14)3-9(10)13/h3-4,18H,1-2H3