4-but-3-en-2-yl-2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one

Systemtic Name: 4-but-3-en-2-yl-2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one Openeye Name: 4-(1-methylallyl)-2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one CAS Name: 4-but-3-en-2-yl-2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one IUPAC Name: 4-but-3-en-2-yl-2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one Traditional Name: 4-(1-methylallyl)-2-phenyl-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C14H13F3N2O MolecularWeight: 282.26103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)C1=C(NN(C1=O)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C=C)C1=C(NN(C1=O)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H13F3N2O/c1-3-9(2)11-12(14(15,16)17)18-19(13(11)20)10-7-5-4-6-8-10/h3-9,18H,1H2,2H3