3-[4-(4-fluoranylphenoxy)phenyl]hex-1-yn-3-yl 2,2-dimethylpropanoate

Systemtic Name: 3-[4-(4-fluoranylphenoxy)phenyl]hex-1-yn-3-yl 2,2-dimethylpropanoate Openeye Name: [1-ethynyl-1-[4-(4-fluorophenoxy)phenyl]butyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 3-[4-(4-fluorophenoxy)phenyl]hex-1-yn-3-yl ester IUPAC Name: 3-[4-(4-fluorophenoxy)phenyl]hex-1-yn-3-yl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-[4-(4-fluorophenoxy)phenyl]-1-propyl-prop-2-ynyl] ester Formula: C23H25FO3 MolecularWeight: 368.441203

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)F)OC(=O)C(C)(C)C

Isomeric SMILES

CCCC(C#C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)F)OC(=O)C(C)(C)C

InChI

InChI=1S/C23H25FO3/c1-6-16-23(7-2,27-21(25)22(3,4)5)17-8-12-19(13-9-17)26-20-14-10-18(24)11-15-20/h2,8-15H,6,16H2,1,3-5H3