5-butyl-2-ethyl-5-[(2-fluorophenyl)methoxy]-1,3-dioxane

Systemtic Name: 5-butyl-2-ethyl-5-[(2-fluorophenyl)methoxy]-1,3-dioxane Openeye Name: 5-butyl-2-ethyl-5-[(2-fluorophenyl)methoxy]-1,3-dioxane CAS Name: 5-butyl-2-ethyl-5-[(2-fluorophenyl)methoxy]-1,3-dioxane IUPAC Name: 5-butyl-2-ethyl-5-[(2-fluorophenyl)methoxy]-1,3-dioxane Traditional Name: 5-butyl-2-ethyl-5-(2-fluorobenzyl)oxy-1,3-dioxane Formula: C17H25FO3 MolecularWeight: 296.377003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(COC(OC1)CC)OCC2=CC=CC=C2F

Isomeric SMILES

CCCCC1(COC(OC1)CC)OCC2=CC=CC=C2F

InChI

InChI=1S/C17H25FO3/c1-3-5-10-17(12-19-16(4-2)20-13-17)21-11-14-8-6-7-9-15(14)18/h6-9,16H,3-5,10-13H2,1-2H3