O1-[2-(4-methylcyclohexyl)propan-2-yl] O5-[2-(3-oxidanyl-1-adamantyl)propan-2-yl] 4-ethyl-2-methyl-pentanedioate

Systemtic Name: O1-[2-(4-methylcyclohexyl)propan-2-yl] O5-[2-(3-oxidanyl-1-adamantyl)propan-2-yl] 4-ethyl-2-methyl-pentanedioate Openeye Name: O1-[1-(3-hydroxy-1-adamantyl)-1-methyl-ethyl] O5-[1-methyl-1-(4-methylcyclohexyl)ethyl] 2-ethyl-4-methyl-pentanedioate CAS Name: 2-ethyl-4-methylpentanedioic acid O1-[2-(3-hydroxy-1-adamantyl)propan-2-yl] ester O5-[2-(4-methylcyclohexyl)propan-2-yl] ester IUPAC Name: 1-O-[2-(3-hydroxy-1-adamantyl)propan-2-yl] 5-O-[2-(4-methylcyclohexyl)propan-2-yl] 2-ethyl-4-methylpentanedioate Traditional Name: 2-ethyl-4-methyl-glutaric acid O1-[1-(3-hydroxy-1-adamantyl)-1-methyl-ethyl] ester O5-[1-methyl-1-(4-methylcyclohexyl)ethyl] ester Formula: C31H52O5 MolecularWeight: 504.74158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OC(C)(C)C1CCC(CC1)C)C(=O)OC(C)(C)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CCC(CC(C)C(=O)OC(C)(C)C1CCC(CC1)C)C(=O)OC(C)(C)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C31H52O5/c1-8-24(13-21(3)26(32)35-28(4,5)25-11-9-20(2)10-12-25)27(33)36-29(6,7)30-15-22-14-23(16-30)18-31(34,17-22)19-30/h20-25,34H,8-19H2,1-7H3