4-[(4-ethylphenyl)methyl]-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 4-[(4-ethylphenyl)methyl]-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-[(4-ethylphenyl)methyl]-5-(trifluoromethyl)pyrazol-3-one CAS Name: 4-[(4-ethylphenyl)methyl]-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 4-[(4-ethylphenyl)methyl]-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 4-(4-ethylbenzyl)-5-(trifluoromethyl)pyrazol-3-one Formula: C13H11F3N2O MolecularWeight: 268.23445

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(N=NC2=O)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(N=NC2=O)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O/c1-2-8-3-5-9(6-4-8)7-10-11(13(14,15)16)17-18-12(10)19/h3-6H,2,7H2,1H3