1-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]-4-(trifluoromethyl)benzene

Systemtic Name: 1-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]-4-(trifluoromethyl)benzene Openeye Name: 1-[1-ethyl-1-methyl-4-(3-phenoxyphenyl)butyl]-4-(trifluoromethyl)benzene CAS Name: 1-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]-4-(trifluoromethyl)benzene IUPAC Name: 1-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]-4-(trifluoromethyl)benzene Traditional Name: 1-[1-ethyl-1-methyl-4-(3-phenoxyphenyl)butyl]-4-(trifluoromethyl)benzene Formula: C26H27F3O MolecularWeight: 412.48719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27F3O/c1-3-25(2,21-14-16-22(17-15-21)26(27,28)29)18-8-10-20-9-7-13-24(19-20)30-23-11-5-4-6-12-23/h4-7,9,11-17,19H,3,8,10,18H2,1-2H3