[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] (2S)-3-oxidanyl-2-phenyl-propanoate

Systemtic Name: [(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] (2S)-3-oxidanyl-2-phenyl-propanoate Openeye Name: [(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] (2S)-3-hydroxy-2-phenyl-propanoate CAS Name: (2S)-3-hydroxy-2-phenylpropanoic acid [(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] ester IUPAC Name: [(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate Traditional Name: (2S)-3-hydroxy-2-phenyl-propionic acid [(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl] ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3

Isomeric SMILES

CN1[C@@H]2CCC[C@H]1CC(C2)OC(=O)[C@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C18H25NO3/c1-19-14-8-5-9-15(19)11-16(10-14)22-18(21)17(12-20)13-6-3-2-4-7-13/h2-4,6-7,14-17,20H,5,8-12H2,1H3/t14-,15+,16?,17-/m1/s1