[4,5-dicarboxyoxy-2-(4-methylpentoxycarbonyloxy)cyclohexyl] 4-methylpentyl carbonate

Systemtic Name: [4,5-dicarboxyoxy-2-(4-methylpentoxycarbonyloxy)cyclohexyl] 4-methylpentyl carbonate Openeye Name: (4,5-dicarboxyoxy-2-isohexyloxycarbonyloxy-cyclohexyl) isohexyl carbonate CAS Name: carbonic acid [4,5-dicarboxyoxy-2-[4-methylpentoxy(oxo)methoxy]cyclohexyl] 4-methylpentyl ester IUPAC Name: [4,5-dicarboxyoxy-2-(4-methylpentoxycarbonyloxy)cyclohexyl] 4-methylpentyl carbonate Traditional Name: carbonic acid (4,5-dicarboxyoxy-2-isohexyloxycarbonyloxy-cyclohexyl) isohexyl ester Formula: C22H36O12 MolecularWeight: 492.51404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)OC1CC(C(CC1OC(=O)OCCCC(C)C)OC(=O)O)OC(=O)O

Isomeric SMILES

CC(C)CCCOC(=O)OC1CC(C(CC1OC(=O)OCCCC(C)C)OC(=O)O)OC(=O)O

InChI

InChI=1S/C22H36O12/c1-13(2)7-5-9-29-21(27)33-17-11-15(31-19(23)24)16(32-20(25)26)12-18(17)34-22(28)30-10-6-8-14(3)4/h13-18H,5-12H2,1-4H3,(H,23,24)(H,25,26)