[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-(5-methoxy-4-methyl-2-oxidanyl-phenyl)-2-oxidanyl-propanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-(5-methoxy-4-methyl-2-oxidanyl-phenyl)-2-oxidanyl-propanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2S)-2-hydroxy-2-(2-hydroxy-5-methoxy-4-methyl-phenyl)propanoate CAS Name: (2S)-2-hydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-hydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propanoate Traditional Name: (2S)-2-hydroxy-2-(2-hydroxy-5-methoxy-4-methyl-phenyl)propionic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C21H32O5 MolecularWeight: 364.47578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O5/c1-12(2)15-8-7-13(3)9-19(15)26-20(23)21(5,24)16-11-18(25-6)14(4)10-17(16)22/h10-13,15,19,22,24H,7-9H2,1-6H3/t13-,15+,19-,21+/m1/s1