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

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 5-oxidanylidene-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 1-benzyl-5-oxo-pyrrolidine-2-carboxylate CAS Name: 5-oxo-1-(phenylmethyl)-2-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] 1-benzyl-5-oxopyrrolidine-2-carboxylate Traditional Name: 1-benzyl-5-keto-pyrrolidine-2-carboxylic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CCC(=O)N2CC3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2CCC(=O)N2CC3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C28H35NO3/c1-20-14-15-23(28(2,3)22-12-8-5-9-13-22)25(18-20)32-27(31)24-16-17-26(30)29(24)19-21-10-6-4-7-11-21/h4-13,20,23-25H,14-19H2,1-3H3/t20-,23-,24?,25-/m1/s1