이름: cyclooctyne

IUPAC: 4-[(1-fluorocyclooct-2-yn-1-yl)methyl]benzoic acid

SMILES: O=C(O)c1ccc(CC2(F)C#CCCCCC2)cc1

Canonical SMILES: C1CCC#CC(CC1)(CC2=CC=C(C=C2)C(=O)O)F

분자식: C16H17FO2

분자량: 260.30

InChIKey: BPIOJHYGHPDOFG-UHFFFAOYSA-N

InChI: InChI=1S/C16H17FO2/c17-16(10-4-2-1-3-5-11-16)12-13-6-8-14(9-7-13)15(18)19/h6-9H,1-4,10,12H2,(H,18,19)

동의어

SCHEMBL764444BPIOJHYGHPDOFG-UHFFFAOYSA-N4-(1-Fluoro-cyclooct-2-ynylmethyl)benzoic acid4-[(1-fluorocyclooct-2-ynyl)methyl]-benzoic acid

확장 검색