1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)butan-1-one CAS Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)butan-1-one Formula: C12H12FN3O MolecularWeight: 233.241583

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=C(C=C1)F)N2C=NC=N2

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)F)N2C=NC=N2

InChI

InChI=1S/C12H12FN3O/c1-2-11(16-8-14-7-15-16)12(17)9-3-5-10(13)6-4-9/h3-8,11H,2H2,1H3