(2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 5-methyl-2-oxidanyl-2-propan-2-yl-hex-5-en-3-ynoate

Systemtic Name: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 5-methyl-2-oxidanyl-2-propan-2-yl-hex-5-en-3-ynoate Openeye Name: (2-methylquinuclidin-3-yl) 2-hydroxy-2-isopropyl-5-methyl-hex-5-en-3-ynoate CAS Name: 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoic acid (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) ester IUPAC Name: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate Traditional Name: 2-hydroxy-2-isopropyl-5-methyl-hex-5-en-3-ynoic acid (2-methylquinuclidin-3-yl) ester Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)OC(=O)C(C#CC(=C)C)(C(C)C)O

Isomeric SMILES

CC1C(C2CCN1CC2)OC(=O)C(C#CC(=C)C)(C(C)C)O

InChI

InChI=1S/C18H27NO3/c1-12(2)6-9-18(21,13(3)4)17(20)22-16-14(5)19-10-7-15(16)8-11-19/h13-16,21H,1,7-8,10-11H2,2-5H3