1-azabicyclo[2.2.2]octan-3-yl (E)-2-cyclopentyl-2-oxidanyl-hex-3-enoate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl (E)-2-cyclopentyl-2-oxidanyl-hex-3-enoate Openeye Name: quinuclidin-3-yl (E)-2-cyclopentyl-2-hydroxy-hex-3-enoate CAS Name: (E)-2-cyclopentyl-2-hydroxy-3-hexenoic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl (E)-2-cyclopentyl-2-hydroxyhex-3-enoate Traditional Name: (E)-2-cyclopentyl-2-hydroxy-hex-3-enoic acid quinuclidin-3-yl ester Formula: C18H29NO3 MolecularWeight: 307.42776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(C1CCCC1)(C(=O)OC2CN3CCC2CC3)O

Isomeric SMILES

CC/C=C/C(C1CCCC1)(C(=O)OC2CN3CCC2CC3)O

InChI

InChI=1S/C18H29NO3/c1-2-3-10-18(21,15-6-4-5-7-15)17(20)22-16-13-19-11-8-14(16)9-12-19/h3,10,14-16,21H,2,4-9,11-13H2,1H3/b10-3+