O1-[2-(1-adamantyl)propan-2-yl] O5-(2-methyl-5-oxidanylidene-hexan-3-yl) 2-ethyl-2,4,4-trimethyl-pentanedioate

Systemtic Name: O1-[2-(1-adamantyl)propan-2-yl] O5-(2-methyl-5-oxidanylidene-hexan-3-yl) 2-ethyl-2,4,4-trimethyl-pentanedioate Openeye Name: O1-[1-(1-adamantyl)-1-methyl-ethyl] O5-(1-isopropyl-3-oxo-butyl) 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-[2-(1-adamantyl)propan-2-yl] ester O5-(2-methyl-5-oxohexan-3-yl) ester IUPAC Name: 1-O-[2-(1-adamantyl)propan-2-yl] 5-O-(2-methyl-5-oxohexan-3-yl) 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 2-ethyl-2,4,4-trimethyl-glutaric acid O1-[1-(1-adamantyl)-1-methyl-ethyl] ester O5-(1-isopropyl-3-keto-butyl) ester Formula: C30H50O5 MolecularWeight: 490.715

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OC(CC(=O)C)C(C)C)C(=O)OC(C)(C)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OC(CC(=O)C)C(C)C)C(=O)OC(C)(C)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C30H50O5/c1-10-29(9,18-27(5,6)25(32)34-24(19(2)3)11-20(4)31)26(33)35-28(7,8)30-15-21-12-22(16-30)14-23(13-21)17-30/h19,21-24H,10-18H2,1-9H3