[3-carboxyoxy-5-(2-ethylhexoxycarbonyloxy)cyclohexyl] 2-ethylhexyl carbonate

Systemtic Name: [3-carboxyoxy-5-(2-ethylhexoxycarbonyloxy)cyclohexyl] 2-ethylhexyl carbonate Openeye Name: [3-carboxyoxy-5-(2-ethylhexoxycarbonyloxy)cyclohexyl] 2-ethylhexyl carbonate CAS Name: carbonic acid [3-carboxyoxy-5-[2-ethylhexoxy(oxo)methoxy]cyclohexyl] 2-ethylhexyl ester IUPAC Name: [3-carboxyoxy-5-(2-ethylhexoxycarbonyloxy)cyclohexyl] 2-ethylhexyl carbonate Traditional Name: carbonic acid [3-carboxyoxy-5-(2-ethylhexoxycarbonyloxy)cyclohexyl] 2-ethylhexyl ester Formula: C25H44O9 MolecularWeight: 488.61146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)OC1CC(CC(C1)OC(=O)OCC(CC)CCCC)OC(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)OC1CC(CC(C1)OC(=O)OCC(CC)CCCC)OC(=O)O

InChI

InChI=1S/C25H44O9/c1-5-9-11-18(7-3)16-30-24(28)33-21-13-20(32-23(26)27)14-22(15-21)34-25(29)31-17-19(8-4)12-10-6-2/h18-22H,5-17H2,1-4H3,(H,26,27)