1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-5-methyl-2-oxidanyl-hex-3-ynoate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-5-methyl-2-oxidanyl-hex-3-ynoate Openeye Name: quinuclidin-3-yl 2-cyclopentyl-2-hydroxy-5-methyl-hex-3-ynoate CAS Name: 2-cyclopentyl-2-hydroxy-5-methyl-3-hexynoic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-hydroxy-5-methylhex-3-ynoate Traditional Name: 2-cyclopentyl-2-hydroxy-5-methyl-hex-3-ynoic acid quinuclidin-3-yl ester Formula: C19H29NO3 MolecularWeight: 319.43846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO3/c1-14(2)7-10-19(22,16-5-3-4-6-16)18(21)23-17-13-20-11-8-15(17)9-12-20/h14-17,22H,3-6,8-9,11-13H2,1-2H3