1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl 3-methyl-2-oxidanyl-2-phenyl-but-3-enoate

Systemtic Name: 1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl 3-methyl-2-oxidanyl-2-phenyl-but-3-enoate Openeye Name: 1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl 2-hydroxy-3-methyl-2-phenyl-but-3-enoate CAS Name: 2-hydroxy-3-methyl-2-phenyl-3-butenoic acid 1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl ester IUPAC Name: 1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl 2-hydroxy-3-methyl-2-phenylbut-3-enoate Traditional Name: 2-hydroxy-3-methyl-2-phenyl-but-3-enoic acid 1-azabicyclo[2.2.2]oct-2-en-3-ylmethyl ester Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO3/c1-14(2)19(22,17-6-4-3-5-7-17)18(21)23-13-16-12-20-10-8-15(16)9-11-20/h3-7,12,15,22H,1,8-11,13H2,2H3