Catalog Number:
AG0005AJ
Chemical Name:
Benzeneacetic acid, α-hydroxy-α-1-pentyn-1-yl-, 1-azabicyclo[2.2.2]oct-3-yl ester
CAS Number:
101711-11-9
Molecular Formula:
C20H25NO3
Molecular Weight:
327.4174
IUPAC Name:
1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-2-phenylhept-3-ynoate
InChI:
InChI=1S/C20H25NO3/c1-2-3-7-12-20(23,17-8-5-4-6-9-17)19(22)24-18-15-21-13-10-16(18)11-14-21/h4-6,8-9,16,18,23H,2-3,10-11,13-15H2,1H3
InChI Key:
YNSMYWAXUANYJM-UHFFFAOYSA-N
SMILES:
CCCC#CC(c1ccccc1)(C(=O)OC1CN2CCC1CC2)O