1-fluoranyl-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxy-benzene

Systemtic Name: 1-fluoranyl-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxy-benzene Openeye Name: 1-fluoro-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxy-benzene CAS Name: 1-fluoro-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxybenzene IUPAC Name: 1-fluoro-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxybenzene Traditional Name: 1-fluoro-4-[[2-methyl-2-(4-propoxyphenyl)butoxy]methyl]-2-phenoxy-benzene Formula: C27H31FO3 MolecularWeight: 422.531643

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C)(CC)COCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(C)(CC)COCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

InChI

InChI=1S/C27H31FO3/c1-4-17-30-23-14-12-22(13-15-23)27(3,5-2)20-29-19-21-11-16-25(28)26(18-21)31-24-9-7-6-8-10-24/h6-16,18H,4-5,17,19-20H2,1-3H3