[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] pyrrolidine-1-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] pyrrolidine-1-carboxylate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] pyrrolidine-1-carboxylate CAS Name: 1-pyrrolidinecarboxylic 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] pyrrolidine-1-carboxylate Traditional Name: pyrrolidine-1-carboxylic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)N2CCCC2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)N2CCCC2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C21H31NO2/c1-16-11-12-18(21(2,3)17-9-5-4-6-10-17)19(15-16)24-20(23)22-13-7-8-14-22/h4-6,9-10,16,18-19H,7-8,11-15H2,1-3H3/t16-,18-,19-/m1/s1