[2-carboxyoxy-6-(8-methylnonoxycarbonyloxy)cyclohexyl] 8-methylnonyl carbonate

Systemtic Name: [2-carboxyoxy-6-(8-methylnonoxycarbonyloxy)cyclohexyl] 8-methylnonyl carbonate Openeye Name: [2-carboxyoxy-6-(8-methylnonoxycarbonyloxy)cyclohexyl] 8-methylnonyl carbonate CAS Name: carbonic acid [2-carboxyoxy-6-[8-methylnonoxy(oxo)methoxy]cyclohexyl] 8-methylnonyl ester IUPAC Name: [2-carboxyoxy-6-(8-methylnonoxycarbonyloxy)cyclohexyl] 8-methylnonyl carbonate Traditional Name: carbonic acid [2-carboxyoxy-6-(8-methylnonoxycarbonyloxy)cyclohexyl] 8-methylnonyl ester Formula: C29H52O9 MolecularWeight: 544.71778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCOC(=O)OC1CCCC(C1OC(=O)OCCCCCCCC(C)C)OC(=O)O

Isomeric SMILES

CC(C)CCCCCCCOC(=O)OC1CCCC(C1OC(=O)OCCCCCCCC(C)C)OC(=O)O

InChI

InChI=1S/C29H52O9/c1-22(2)16-11-7-5-9-13-20-34-28(32)37-25-19-15-18-24(36-27(30)31)26(25)38-29(33)35-21-14-10-6-8-12-17-23(3)4/h22-26H,5-21H2,1-4H3,(H,30,31)