5-(4-chloranyl-2-fluoranyl-5-iodanyl-phenyl)-2,4-dimethyl-pyrazole-3-carbonitrile

Systemtic Name: 5-(4-chloranyl-2-fluoranyl-5-iodanyl-phenyl)-2,4-dimethyl-pyrazole-3-carbonitrile Openeye Name: 5-(4-chloro-2-fluoro-5-iodo-phenyl)-2,4-dimethyl-pyrazole-3-carbonitrile CAS Name: 5-(4-chloro-2-fluoro-5-iodophenyl)-2,4-dimethyl-3-pyrazolecarbonitrile IUPAC Name: 5-(4-chloro-2-fluoro-5-iodophenyl)-2,4-dimethylpyrazole-3-carbonitrile Traditional Name: 5-(4-chloro-2-fluoro-5-iodo-phenyl)-2,4-dimethyl-pyrazole-3-carbonitrile Formula: C12H8ClFIN3 MolecularWeight: 375.567893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC(=C(C=C2F)Cl)I)C)C#N

Isomeric SMILES

CC1=C(N(N=C1C2=CC(=C(C=C2F)Cl)I)C)C#N

InChI

InChI=1S/C12H8ClFIN3/c1-6-11(5-16)18(2)17-12(6)7-3-10(15)8(13)4-9(7)14/h3-4H,1-2H3