2-(1-adamantyl)propan-2-yl 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-oxidanyl-hexanoate

Systemtic Name: 2-(1-adamantyl)propan-2-yl 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-oxidanyl-hexanoate Openeye Name: [1-(1-adamantyl)-1-methyl-ethyl] 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-hydroxy-hexanoate CAS Name: 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-hydroxyhexanoic acid 2-(1-adamantyl)propan-2-yl ester IUPAC Name: 2-(1-adamantyl)propan-2-yl 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-hydroxyhexanoate Traditional Name: 6-(5-bicyclo[2.2.1]hept-2-enyl)-3-hydroxy-hexanoic acid [1-(1-adamantyl)-1-methyl-ethyl] ester Formula: C26H40O3 MolecularWeight: 400.594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C12CC3CC(C1)CC(C3)C2)OC(=O)CC(CCCC4CC5CC4C=C5)O

Isomeric SMILES

CC(C)(C12CC3CC(C1)CC(C3)C2)OC(=O)CC(CCCC4CC5CC4C=C5)O

InChI

InChI=1S/C26H40O3/c1-25(2,26-14-18-8-19(15-26)10-20(9-18)16-26)29-24(28)13-23(27)5-3-4-21-11-17-6-7-22(21)12-17/h6-7,17-23,27H,3-5,8-16H2,1-2H3