[(2S)-1-fluoranylpropan-2-yl] (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: [(2S)-1-fluoranylpropan-2-yl] (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: [(1S)-2-fluoro-1-methyl-ethyl] (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid [(2S)-1-fluoropropan-2-yl] ester IUPAC Name: [(2S)-1-fluoropropan-2-yl] (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid [(1S)-2-fluoro-1-methyl-ethyl] ester Formula: C18H23ClFNO2 MolecularWeight: 339.832123

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Descriptors Computed from Structure

Canonical SMILES:

CC(CF)OC(=O)C1C2CCC(N2C)CC1C3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@@H](CF)OC(=O)[C@@H]1[C@H]2CC[C@H](N2C)C[C@@H]1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClFNO2/c1-11(10-20)23-18(22)17-15(12-3-5-13(19)6-4-12)9-14-7-8-16(17)21(14)2/h3-6,11,14-17H,7-10H2,1-2H3/t11-,14-,15+,16+,17-/m0/s1