[(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-phenylcyclohexane-1-carboxylate

Systemtic Name: [(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-phenylcyclohexane-1-carboxylate Openeye Name: [(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-phenylcyclohexanecarboxylate CAS Name: 2-phenyl-1-cyclohexanecarboxylic acid [(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester IUPAC Name: [(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-phenylcyclohexane-1-carboxylate Traditional Name: 2-phenylcyclohexanecarboxylic acid [(1R,5S)-8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester Formula: C23H34NO2+ MolecularWeight: 356.52156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C2CCC1CC(C2)OC(=O)C3CCCCC3C4=CC=CC=C4)C

Isomeric SMILES

CC[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C3CCCCC3C4=CC=CC=C4)C

InChI

InChI=1S/C23H34NO2/c1-3-24(2)18-13-14-19(24)16-20(15-18)26-23(25)22-12-8-7-11-21(22)17-9-5-4-6-10-17/h4-6,9-10,18-22H,3,7-8,11-16H2,1-2H3/q+1/t18-,19+,20?,21?,22?,24?