4-[4-(4-ethoxyphenyl)-4-methyl-hex-5-ynyl]-1-fluoranyl-2-phenoxy-benzene

Systemtic Name: 4-[4-(4-ethoxyphenyl)-4-methyl-hex-5-ynyl]-1-fluoranyl-2-phenoxy-benzene Openeye Name: 4-[4-(4-ethoxyphenyl)-4-methyl-hex-5-ynyl]-1-fluoro-2-phenoxy-benzene CAS Name: 4-[4-(4-ethoxyphenyl)-4-methylhex-5-ynyl]-1-fluoro-2-phenoxybenzene IUPAC Name: 4-[4-(4-ethoxyphenyl)-4-methylhex-5-ynyl]-1-fluoro-2-phenoxybenzene Traditional Name: 1-fluoro-4-(4-methyl-4-p-phenetyl-hex-5-ynyl)-2-phenoxy-benzene Formula: C27H27FO2 MolecularWeight: 402.500483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C#C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C#C

InChI

InChI=1S/C27H27FO2/c1-4-27(3,22-14-16-23(17-15-22)29-5-2)19-9-10-21-13-18-25(28)26(20-21)30-24-11-7-6-8-12-24/h1,6-8,11-18,20H,5,9-10,19H2,2-3H3