[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-acetyloxy-2-(4-chlorophenyl)propanoate

Systemtic Name: [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-acetyloxy-2-(4-chlorophenyl)propanoate Openeye Name: [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-acetoxy-2-(4-chlorophenyl)propanoate CAS Name: (2R)-3-acetyloxy-2-(4-chlorophenyl)propanoic acid [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] ester IUPAC Name: [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-acetyloxy-2-(4-chlorophenyl)propanoate Traditional Name: (2R)-3-acetoxy-2-(4-chlorophenyl)propionic acid [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] ester Formula: C18H22ClNO4 MolecularWeight: 351.82458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C1=CC=C(C=C1)Cl)C(=O)OC2CC3CCC(C2)N3

Isomeric SMILES

CC(=O)OC[C@@H](C1=CC=C(C=C1)Cl)C(=O)OC2C[C@H]3CC[C@@H](C2)N3

InChI

InChI=1S/C18H22ClNO4/c1-11(21)23-10-17(12-2-4-13(19)5-3-12)18(22)24-16-8-14-6-7-15(9-16)20-14/h2-5,14-17,20H,6-10H2,1H3/t14-,15+,16?,17-/m0/s1