5-butan-2-yl-4-fluoranyl-1,2-dihydropyrazol-3-one

Systemtic Name: 5-butan-2-yl-4-fluoranyl-1,2-dihydropyrazol-3-one Openeye Name: 4-fluoro-5-sec-butyl-1,2-dihydropyrazol-3-one CAS Name: 5-butan-2-yl-4-fluoro-1,2-dihydropyrazol-3-one IUPAC Name: 5-butan-2-yl-4-fluoro-1,2-dihydropyrazol-3-one Traditional Name: 4-fluoro-5-sec-butyl-3-pyrazolin-3-one Formula: C7H11FN2O MolecularWeight: 158.173443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C(=O)NN1)F

Isomeric SMILES

CCC(C)C1=C(C(=O)NN1)F

InChI

InChI=1S/C7H11FN2O/c1-3-4(2)6-5(8)7(11)10-9-6/h4H,3H2,1-2H3,(H2,9,10,11)