1,2,4-tris(fluoranyl)-3-pentoxy-5-(2-phenylethynyl)benzene

Systemtic Name: 1,2,4-tris(fluoranyl)-3-pentoxy-5-(2-phenylethynyl)benzene Openeye Name: 1,2,4-trifluoro-3-pentoxy-5-(2-phenylethynyl)benzene CAS Name: 1,2,4-trifluoro-3-pentoxy-5-(2-phenylethynyl)benzene IUPAC Name: 1,2,4-trifluoro-3-pentoxy-5-(2-phenylethynyl)benzene Traditional Name: 3-amoxy-1,2,4-trifluoro-5-(2-phenylethynyl)benzene Formula: C19H17F3O MolecularWeight: 318.33289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=CC(=C1F)F)C#CC2=CC=CC=C2)F

Isomeric SMILES

CCCCCOC1=C(C(=CC(=C1F)F)C#CC2=CC=CC=C2)F

InChI

InChI=1S/C19H17F3O/c1-2-3-7-12-23-19-17(21)15(13-16(20)18(19)22)11-10-14-8-5-4-6-9-14/h4-6,8-9,13H,2-3,7,12H2,1H3