[3-(2-ethylhexanoyloxy)-2-(2-ethylhexanoyloxymethyl)-2-methyl-propyl] 2-ethylhexanoate

Systemtic Name: [3-(2-ethylhexanoyloxy)-2-(2-ethylhexanoyloxymethyl)-2-methyl-propyl] 2-ethylhexanoate Openeye Name: [3-(2-ethylhexanoyloxy)-2-(2-ethylhexanoyloxymethyl)-2-methyl-propyl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [3-(2-ethyl-1-oxohexoxy)-2-[(2-ethyl-1-oxohexoxy)methyl]-2-methylpropyl] ester IUPAC Name: [3-(2-ethylhexanoyloxy)-2-(2-ethylhexanoyloxymethyl)-2-methylpropyl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [3-(2-ethylhexanoyloxy)-2-(2-ethylhexanoyloxymethyl)-2-methyl-propyl] ester Formula: C29H54O6 MolecularWeight: 498.73546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OCC(C)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC

Isomeric SMILES

CCCCC(CC)C(=O)OCC(C)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC

InChI

InChI=1S/C29H54O6/c1-8-14-17-23(11-4)26(30)33-20-29(7,21-34-27(31)24(12-5)18-15-9-2)22-35-28(32)25(13-6)19-16-10-3/h23-25H,8-22H2,1-7H3