2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-ethyl-4H-pyrazol-3-one

Systemtic Name: 2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-ethyl-4H-pyrazol-3-one Openeye Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-ethyl-4H-pyrazol-3-one CAS Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-ethyl-4H-pyrazol-3-one IUPAC Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-ethyl-4H-pyrazol-3-one Traditional Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-ethyl-2-pyrazolin-3-one Formula: C12H9Cl2F3N2O MolecularWeight: 325.11387

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

Isomeric SMILES

CCC1=NN(C(=O)C1)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

InChI

InChI=1S/C12H9Cl2F3N2O/c1-2-7-5-10(20)19(18-7)11-8(13)3-6(4-9(11)14)12(15,16)17/h3-4H,2,5H2,1H3