5-[6-(4-fluoranyl-3-phenoxy-phenyl)-3-methyl-hexan-3-yl]-1,3-benzodioxole

Systemtic Name: 5-[6-(4-fluoranyl-3-phenoxy-phenyl)-3-methyl-hexan-3-yl]-1,3-benzodioxole Openeye Name: 5-[1-ethyl-4-(4-fluoro-3-phenoxy-phenyl)-1-methyl-butyl]-1,3-benzodioxole CAS Name: 5-[6-(4-fluoro-3-phenoxyphenyl)-3-methylhexan-3-yl]-1,3-benzodioxole IUPAC Name: 5-[6-(4-fluoro-3-phenoxyphenyl)-3-methylhexan-3-yl]-1,3-benzodioxole Traditional Name: 5-[1-ethyl-4-(4-fluoro-3-phenoxy-phenyl)-1-methyl-butyl]-1,3-benzodioxole Formula: C26H27FO3 MolecularWeight: 406.489183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCCC1=CC(=C(C=C1)F)OC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC(C)(CCCC1=CC(=C(C=C1)F)OC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H27FO3/c1-3-26(2,20-12-14-23-25(17-20)29-18-28-23)15-7-8-19-11-13-22(27)24(16-19)30-21-9-5-4-6-10-21/h4-6,9-14,16-17H,3,7-8,15,18H2,1-2H3