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

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl (E)-2-oxidanyl-2-phenyl-hex-3-enoate Openeye Name: quinuclidin-3-yl (E)-2-hydroxy-2-phenyl-hex-3-enoate CAS Name: (E)-2-hydroxy-2-phenyl-3-hexenoic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl (E)-2-hydroxy-2-phenylhex-3-enoate Traditional Name: (E)-2-hydroxy-2-phenyl-hex-3-enoic acid quinuclidin-3-yl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(C1=CC=CC=C1)(C(=O)OC2CN3CCC2CC3)O

Isomeric SMILES

CC/C=C/C(C1=CC=CC=C1)(C(=O)OC2CN3CCC2CC3)O

InChI

InChI=1S/C19H25NO3/c1-2-3-11-19(22,16-7-5-4-6-8-16)18(21)23-17-14-20-12-9-15(17)10-13-20/h3-8,11,15,17,22H,2,9-10,12-14H2,1H3/b11-3+