(2,2,4-tricyclohexyl-3-oxidanyl-butyl) 2,2-dicyclohexylethanoate

Systemtic Name: (2,2,4-tricyclohexyl-3-oxidanyl-butyl) 2,2-dicyclohexylethanoate Openeye Name: (2,2,4-tricyclohexyl-3-hydroxy-butyl) 2,2-dicyclohexylacetate CAS Name: 2,2-dicyclohexylacetic acid (2,2,4-tricyclohexyl-3-hydroxybutyl) ester IUPAC Name: (2,2,4-tricyclohexyl-3-hydroxybutyl) 2,2-dicyclohexylacetate Traditional Name: 2,2-dicyclohexylacetic acid (2,2,4-tricyclohexyl-3-hydroxy-butyl) ester Formula: C36H62O3 MolecularWeight: 542.87568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(COC(=O)C(C2CCCCC2)C3CCCCC3)(C4CCCCC4)C5CCCCC5)O

Isomeric SMILES

C1CCC(CC1)CC(C(COC(=O)C(C2CCCCC2)C3CCCCC3)(C4CCCCC4)C5CCCCC5)O

InChI

InChI=1S/C36H62O3/c37-33(26-28-16-6-1-7-17-28)36(31-22-12-4-13-23-31,32-24-14-5-15-25-32)27-39-35(38)34(29-18-8-2-9-19-29)30-20-10-3-11-21-30/h28-34,37H,1-27H2