(E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethyloxy)phenyl]pent-1-en-3-one

Systemtic Name: (E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethyloxy)phenyl]pent-1-en-3-one Openeye Name: (E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethoxy)phenyl]pent-1-en-3-one CAS Name: (E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethoxy)phenyl]-1-penten-3-one IUPAC Name: (E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethoxy)phenyl]pent-1-en-3-one Traditional Name: (E)-4-(1,2,4-triazol-1-yl)-1-[4-(trifluoromethoxy)phenyl]pent-1-en-3-one Formula: C14H12F3N3O2 MolecularWeight: 311.25919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CC1=CC=C(C=C1)OC(F)(F)F)N2C=NC=N2

Isomeric SMILES

CC(C(=O)/C=C/C1=CC=C(C=C1)OC(F)(F)F)N2C=NC=N2

InChI

InChI=1S/C14H12F3N3O2/c1-10(20-9-18-8-19-20)13(21)7-4-11-2-5-12(6-3-11)22-14(15,16)17/h2-10H,1H3/b7-4+