2-[4-(4-fluorophenyl)phenyl]but-3-yn-2-yl 2,2-dimethylpropanoate

Systemtic Name: 2-[4-(4-fluorophenyl)phenyl]but-3-yn-2-yl 2,2-dimethylpropanoate Openeye Name: [1-[4-(4-fluorophenyl)phenyl]-1-methyl-prop-2-ynyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[4-(4-fluorophenyl)phenyl]but-3-yn-2-yl ester IUPAC Name: 2-[4-(4-fluorophenyl)phenyl]but-3-yn-2-yl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-[4-(4-fluorophenyl)phenyl]-1-methyl-prop-2-ynyl] ester Formula: C21H21FO2 MolecularWeight: 324.388643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FO2/c1-6-21(5,24-19(23)20(2,3)4)17-11-7-15(8-12-17)16-9-13-18(22)14-10-16/h1,7-14H,2-5H3