Smiles:
O=C(C(c1ccccc1)(c1ccccc1)O)O[C@H]1C[N@@H+]2CC[C@H]1CC2

Netcharge:
1

InChIKey:
HGMITUYOCPPQLE-QMFRYXOKNA-O

InChI:

1/C21H23NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,16,19,24H,11-15H2/p+1/t19-/m0/s1/fC21H24NO3/h22H/q+1

InChIcol:
1

More information (from its Standard Form):

QUINUCLIDINYL BENZILATE

Complex structures in which this molecule appears :

Complex Structure ID: 111

References in which this molecule is mentioned:

Ismael Rodríguez-Espigares, Mariona Torrens-Fontanals, et al.. 2020. GPCRmd uncovers the dynamics of the 3D-GPCRome. Nature methods 17 (8). doi: 10.1038/s41592-020-0884-y.

Download the SDF file