1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one

Systemtic Name: 1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one Openeye Name: 1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethyl-1-hexanone IUPAC Name: 1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one Formula: C18H24FN3O2 MolecularWeight: 333.400463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1C(=NC(=N1)OCC)C2=CC(=CC=C2)F

Isomeric SMILES

CCCCC(CC)C(=O)N1C(=NC(=N1)OCC)C2=CC(=CC=C2)F

InChI

InChI=1S/C18H24FN3O2/c1-4-7-9-13(5-2)17(23)22-16(20-18(21-22)24-6-3)14-10-8-11-15(19)12-14/h8,10-13H,4-7,9H2,1-3H3