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

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] benzoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] benzoate CAS Name: benzoic 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] benzoate Traditional Name: benzoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C23H28O2 MolecularWeight: 336.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC=CC=C2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2=CC=CC=C2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C23H28O2/c1-17-14-15-20(23(2,3)19-12-8-5-9-13-19)21(16-17)25-22(24)18-10-6-4-7-11-18/h4-13,17,20-21H,14-16H2,1-3H3/t17-,20-,21-/m1/s1