ethyl 4-[(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)methoxy]-3-prop-2-enyl-benzoate

Systemtic Name: ethyl 4-[(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)methoxy]-3-prop-2-enyl-benzoate Openeye Name: ethyl 3-allyl-4-[(3-hydroxyquinuclidin-3-yl)methoxy]benzoate CAS Name: 4-[(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)methoxy]-3-prop-2-enylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)methoxy]-3-prop-2-enylbenzoate Traditional Name: 3-allyl-4-[(3-hydroxyquinuclidin-3-yl)methoxy]benzoic acid ethyl ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OCC2(CN3CCC2CC3)O)CC=C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OCC2(CN3CCC2CC3)O)CC=C

InChI

InChI=1S/C20H27NO4/c1-3-5-15-12-16(19(22)24-4-2)6-7-18(15)25-14-20(23)13-21-10-8-17(20)9-11-21/h3,6-7,12,17,23H,1,4-5,8-11,13-14H2,2H3