[(1R,5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl] 3-acetyloxy-2-phenyl-propanoate

Systemtic Name: [(1R,5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl] 3-acetyloxy-2-phenyl-propanoate Openeye Name: [(1R,5S)-8-isopropyl-8-azabicyclo[3.2.1]octan-3-yl] 3-acetoxy-2-phenyl-propanoate CAS Name: 3-acetyloxy-2-phenylpropanoic acid [(1R,5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl] ester IUPAC Name: [(1R,5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl] 3-acetyloxy-2-phenylpropanoate Traditional Name: 3-acetoxy-2-phenyl-propionic acid [(1R,5S)-8-isopropyl-8-azabicyclo[3.2.1]octan-3-yl] ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2CCC1CC(C2)OC(=O)C(COC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)N1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(COC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C21H29NO4/c1-14(2)22-17-9-10-18(22)12-19(11-17)26-21(24)20(13-25-15(3)23)16-7-5-4-6-8-16/h4-8,14,17-20H,9-13H2,1-3H3/t17-,18+,19?,20?