1-tert-butyl-4-[5-(4-fluoranyl-3-phenoxy-phenyl)-2-methyl-pentan-2-yl]-2-methyl-benzene

Systemtic Name: 1-tert-butyl-4-[5-(4-fluoranyl-3-phenoxy-phenyl)-2-methyl-pentan-2-yl]-2-methyl-benzene Openeye Name: 1-tert-butyl-4-[4-(4-fluoro-3-phenoxy-phenyl)-1,1-dimethyl-butyl]-2-methyl-benzene CAS Name: 1-tert-butyl-4-[5-(4-fluoro-3-phenoxyphenyl)-2-methylpentan-2-yl]-2-methylbenzene IUPAC Name: 1-tert-butyl-4-[5-(4-fluoro-3-phenoxyphenyl)-2-methylpentan-2-yl]-2-methylbenzene Traditional Name: 1-tert-butyl-4-[4-(4-fluoro-3-phenoxy-phenyl)-1,1-dimethyl-butyl]-2-methyl-benzene Formula: C29H35FO MolecularWeight: 418.586003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C29H35FO/c1-21-19-23(15-16-25(21)28(2,3)4)29(5,6)18-10-11-22-14-17-26(30)27(20-22)31-24-12-8-7-9-13-24/h7-9,12-17,19-20H,10-11,18H2,1-6H3