[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2,4-dimethyl-3-oxidanyl-pentanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2,4-dimethyl-3-oxidanyl-pentanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 3-hydroxy-2,4-dimethyl-pentanoate CAS Name: 3-hydroxy-2,4-dimethylpentanoic 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] 3-hydroxy-2,4-dimethylpentanoate Traditional Name: 3-hydroxy-2,4-dimethyl-valeric acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C)C(C(C)C)O)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(C)C(C(C)C)O)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C23H36O3/c1-15(2)21(24)17(4)22(25)26-20-14-16(3)12-13-19(20)23(5,6)18-10-8-7-9-11-18/h7-11,15-17,19-21,24H,12-14H2,1-6H3/t16-,17?,19-,20-,21?/m1/s1