(2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-oxidanyl-2-prop-1-en-2-yl-heptanoate

Systemtic Name: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-oxidanyl-2-prop-1-en-2-yl-heptanoate Openeye Name: (2-methylquinuclidin-3-yl) 2-hydroxy-2-isopropenyl-heptanoate CAS Name: 2-hydroxy-2-(1-methylethenyl)heptanoic 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-2-prop-1-en-2-ylheptanoate Traditional Name: 2-amyl-2-hydroxy-3-methyl-but-3-enoic acid (2-methylquinuclidin-3-yl) ester Formula: C18H31NO3 MolecularWeight: 309.44364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=C)C)(C(=O)OC1C(N2CCC1CC2)C)O

Isomeric SMILES

CCCCCC(C(=C)C)(C(=O)OC1C(N2CCC1CC2)C)O

InChI

InChI=1S/C18H31NO3/c1-5-6-7-10-18(21,13(2)3)17(20)22-16-14(4)19-11-8-15(16)9-12-19/h14-16,21H,2,5-12H2,1,3-4H3