4-(4-fluoranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one

Systemtic Name: 4-(4-fluoranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Openeye Name: 4-(4-fluorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one CAS Name: 4-(4-fluorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-pentanone IUPAC Name: 4-(4-fluorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Traditional Name: 4-(4-fluorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Formula: C15H18FN3O2 MolecularWeight: 291.320723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C(=O)CN1C=NC=N1)OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(C)(C)C(=O)CN1C=NC=N1)OC2=CC=C(C=C2)F

InChI

InChI=1S/C15H18FN3O2/c1-11(21-13-6-4-12(16)5-7-13)15(2,3)14(20)8-19-10-17-9-18-19/h4-7,9-11H,8H2,1-3H3