4-fluoranyl-5-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one

Systemtic Name: 4-fluoranyl-5-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one Openeye Name: 4-fluoro-4-isopropyl-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-fluoro-5-methyl-2-phenyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 4-fluoro-5-methyl-2-phenyl-4-propan-2-ylpyrazol-3-one Traditional Name: 4-fluoro-4-isopropyl-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C13H15FN2O MolecularWeight: 234.269403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(C(C)C)F)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1(C(C)C)F)C2=CC=CC=C2

InChI

InChI=1S/C13H15FN2O/c1-9(2)13(14)10(3)15-16(12(13)17)11-7-5-4-6-8-11/h4-9H,1-3H3