[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate CAS Name: (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Traditional Name: (1R,4S)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)N2C3CCC(O2)C=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)N2[C@@H]3CC[C@H](O2)C=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C23H31NO3/c1-16-9-14-20(23(2,3)17-7-5-4-6-8-17)21(15-16)26-22(25)24-18-10-12-19(27-24)13-11-18/h4-8,10,12,16,18-21H,9,11,13-15H2,1-3H3/t16-,18+,19-,20-,21-/m1/s1