3-[(4-fluoranylphenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethyl-pent-1-yn-3-ol

Systemtic Name: 3-[(4-fluoranylphenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethyl-pent-1-yn-3-ol Openeye Name: 3-[(4-fluorophenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethyl-pent-1-yn-3-ol CAS Name: 3-[(4-fluorophenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethyl-1-pentyn-3-ol IUPAC Name: 3-[(4-fluorophenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethylpent-1-yn-3-ol Traditional Name: 3-[(4-fluorophenoxy)-(1,2,4-triazol-1-yl)methyl]-4,4-dimethyl-pent-1-yn-3-ol Formula: C16H18FN3O2 MolecularWeight: 303.331423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C#C)(C(N1C=NC=N1)OC2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)(C)C(C#C)(C(N1C=NC=N1)OC2=CC=C(C=C2)F)O

InChI

InChI=1S/C16H18FN3O2/c1-5-16(21,15(2,3)4)14(20-11-18-10-19-20)22-13-8-6-12(17)7-9-13/h1,6-11,14,21H,2-4H3