1-[2-methyl-5-(3-phenoxyphenyl)pentan-2-yl]-4-[2,2,2-tris(fluoranyl)ethoxy]benzene

Systemtic Name: 1-[2-methyl-5-(3-phenoxyphenyl)pentan-2-yl]-4-[2,2,2-tris(fluoranyl)ethoxy]benzene Openeye Name: 1-[1,1-dimethyl-4-(3-phenoxyphenyl)butyl]-4-(2,2,2-trifluoroethoxy)benzene CAS Name: 1-[2-methyl-5-(3-phenoxyphenyl)pentan-2-yl]-4-(2,2,2-trifluoroethoxy)benzene IUPAC Name: 1-[2-methyl-5-(3-phenoxyphenyl)pentan-2-yl]-4-(2,2,2-trifluoroethoxy)benzene Traditional Name: 1-[1,1-dimethyl-4-(3-phenoxyphenyl)butyl]-4-(2,2,2-trifluoroethoxy)benzene Formula: C26H27F3O2 MolecularWeight: 428.48659

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)OCC(F)(F)F

Isomeric SMILES

CC(C)(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)OCC(F)(F)F

InChI

InChI=1S/C26H27F3O2/c1-25(2,21-13-15-22(16-14-21)30-19-26(27,28)29)17-7-9-20-8-6-12-24(18-20)31-23-10-4-3-5-11-23/h3-6,8,10-16,18H,7,9,17,19H2,1-2H3