5-tert-butyl-2-[2-(4-fluoranylphenoxy)ethyl]-4H-pyrazol-3-one

Systemtic Name: 5-tert-butyl-2-[2-(4-fluoranylphenoxy)ethyl]-4H-pyrazol-3-one Openeye Name: 5-tert-butyl-2-[2-(4-fluorophenoxy)ethyl]-4H-pyrazol-3-one CAS Name: 5-tert-butyl-2-[2-(4-fluorophenoxy)ethyl]-4H-pyrazol-3-one IUPAC Name: 5-tert-butyl-2-[2-(4-fluorophenoxy)ethyl]-4H-pyrazol-3-one Traditional Name: 5-tert-butyl-2-[2-(4-fluorophenoxy)ethyl]-2-pyrazolin-3-one Formula: C15H19FN2O2 MolecularWeight: 278.321963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1)CCOC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C1)CCOC2=CC=C(C=C2)F

InChI

InChI=1S/C15H19FN2O2/c1-15(2,3)13-10-14(19)18(17-13)8-9-20-12-6-4-11(16)5-7-12/h4-7H,8-10H2,1-3H3