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

Systemtic Name: [(1S,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-yl] 3-oxidanyl-2-phenyl-propanoate Openeye Name: [(1S,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-yl] 3-hydroxy-2-phenyl-propanoate CAS Name: 3-hydroxy-2-phenylpropanoic acid [(1S,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-yl] ester IUPAC Name: [(1S,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-yl] 3-hydroxy-2-phenylpropanoate Traditional Name: 3-hydroxy-2-phenyl-propionic acid [(1S,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-yl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2CCCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3

Isomeric SMILES

CCCN1[C@@H]2CCC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3

InChI

InChI=1S/C20H29NO3/c1-2-11-21-16-9-6-10-17(21)13-18(12-16)24-20(23)19(14-22)15-7-4-3-5-8-15/h3-5,7-8,16-19,22H,2,6,9-14H2,1H3/t16-,17+,18?,19?