1-fluoranyl-4-[[2-methyl-2-(4-prop-2-ynoxyphenyl)propoxy]methyl]-2-phenoxy-benzene

Systemtic Name: 1-fluoranyl-4-[[2-methyl-2-(4-prop-2-ynoxyphenyl)propoxy]methyl]-2-phenoxy-benzene Openeye Name: 1-fluoro-4-[[2-methyl-2-(4-prop-2-ynoxyphenyl)propoxy]methyl]-2-phenoxy-benzene CAS Name: 1-fluoro-4-[[2-methyl-2-(4-prop-2-ynoxyphenyl)propoxy]methyl]-2-phenoxybenzene IUPAC Name: 1-fluoro-4-[[2-methyl-2-(4-prop-2-ynoxyphenyl)propoxy]methyl]-2-phenoxybenzene Traditional Name: 1-fluoro-4-[[2-methyl-2-(4-propargyloxyphenyl)propoxy]methyl]-2-phenoxy-benzene Formula: C26H25FO3 MolecularWeight: 404.473303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COCC1=CC(=C(C=C1)F)OC2=CC=CC=C2)C3=CC=C(C=C3)OCC#C

Isomeric SMILES

CC(C)(COCC1=CC(=C(C=C1)F)OC2=CC=CC=C2)C3=CC=C(C=C3)OCC#C

InChI

InChI=1S/C26H25FO3/c1-4-16-29-22-13-11-21(12-14-22)26(2,3)19-28-18-20-10-15-24(27)25(17-20)30-23-8-6-5-7-9-23/h1,5-15,17H,16,18-19H2,2-3H3