1-[2-fluoranyl-4-(4-hexoxyphenyl)phenyl]ethyl 2-methylbutanoate

Systemtic Name: 1-[2-fluoranyl-4-(4-hexoxyphenyl)phenyl]ethyl 2-methylbutanoate Openeye Name: 1-[2-fluoro-4-(4-hexoxyphenyl)phenyl]ethyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid 1-[2-fluoro-4-(4-hexoxyphenyl)phenyl]ethyl ester IUPAC Name: 1-[2-fluoro-4-(4-hexoxyphenyl)phenyl]ethyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid 1-[2-fluoro-4-(4-hexoxyphenyl)phenyl]ethyl ester Formula: C25H33FO3 MolecularWeight: 400.526123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(C)OC(=O)C(C)CC)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(C)OC(=O)C(C)CC)F

InChI

InChI=1S/C25H33FO3/c1-5-7-8-9-16-28-22-13-10-20(11-14-22)21-12-15-23(24(26)17-21)19(4)29-25(27)18(3)6-2/h10-15,17-19H,5-9,16H2,1-4H3