1-[2,6-bis(chloranyl)-4-(trifluoromethyloxy)phenyl]-4-ethanoyl-pyrazole-3-carbonitrile

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyloxy)phenyl]-4-ethanoyl-pyrazole-3-carbonitrile Openeye Name: 4-acetyl-1-[2,6-dichloro-4-(trifluoromethoxy)phenyl]pyrazole-3-carbonitrile CAS Name: 4-acetyl-1-[2,6-dichloro-4-(trifluoromethoxy)phenyl]-3-pyrazolecarbonitrile IUPAC Name: 4-acetyl-1-[2,6-dichloro-4-(trifluoromethoxy)phenyl]pyrazole-3-carbonitrile Traditional Name: 4-acetyl-1-[2,6-dichloro-4-(trifluoromethoxy)phenyl]pyrazole-3-carbonitrile Formula: C13H6Cl2F3N3O2 MolecularWeight: 364.10685

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(N=C1C#N)C2=C(C=C(C=C2Cl)OC(F)(F)F)Cl

Isomeric SMILES

CC(=O)C1=CN(N=C1C#N)C2=C(C=C(C=C2Cl)OC(F)(F)F)Cl

InChI

InChI=1S/C13H6Cl2F3N3O2/c1-6(22)8-5-21(20-11(8)4-19)12-9(14)2-7(3-10(12)15)23-13(16,17)18/h2-3,5H,1H3