[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-(4-tert-butyl-2-oxidanyl-phenyl)-2-oxidanyl-ethanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-(4-tert-butyl-2-oxidanyl-phenyl)-2-oxidanyl-ethanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2S)-2-(4-tert-butyl-2-hydroxy-phenyl)-2-hydroxy-acetate CAS Name: (2S)-2-(4-tert-butyl-2-hydroxyphenyl)-2-hydroxyacetic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-(4-tert-butyl-2-hydroxyphenyl)-2-hydroxyacetate Traditional Name: (2S)-2-(4-tert-butyl-2-hydroxy-phenyl)-2-hydroxy-acetic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34O4/c1-13(2)16-9-7-14(3)11-19(16)26-21(25)20(24)17-10-8-15(12-18(17)23)22(4,5)6/h8,10,12-14,16,19-20,23-24H,7,9,11H2,1-6H3/t14-,16+,19-,20+/m1/s1