[1-carboxyoxy-1,2-bis(5-methyl-2-propan-2-yl-cyclohexyl)propyl] hydrogen carbonate

Systemtic Name: [1-carboxyoxy-1,2-bis(5-methyl-2-propan-2-yl-cyclohexyl)propyl] hydrogen carbonate Openeye Name: [1-carboxyoxy-1,2-bis(2-isopropyl-5-methyl-cyclohexyl)propyl] hydrogen carbonate CAS Name: carbonic acid [1-carboxyoxy-1,2-bis(5-methyl-2-propan-2-ylcyclohexyl)propyl] ester IUPAC Name: [1-carboxyoxy-1,2-bis(5-methyl-2-propan-2-ylcyclohexyl)propyl] hydrogen carbonate Traditional Name: carbonic acid [1-carboxyoxy-1,2-bis(2-isopropyl-5-methyl-cyclohexyl)propyl] ester Formula: C25H44O6 MolecularWeight: 440.61326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(C)C(C2CC(CCC2C(C)C)C)(OC(=O)O)OC(=O)O)C(C)C

Isomeric SMILES

CC1CCC(C(C1)C(C)C(C2CC(CCC2C(C)C)C)(OC(=O)O)OC(=O)O)C(C)C

InChI

InChI=1S/C25H44O6/c1-14(2)19-10-8-16(5)12-21(19)18(7)25(30-23(26)27,31-24(28)29)22-13-17(6)9-11-20(22)15(3)4/h14-22H,8-13H2,1-7H3,(H,26,27)(H,28,29)