3,4-bis(decoxycarbonyl)cyclohexane-1-carboxylic acid

Systemtic Name: 3,4-bis(decoxycarbonyl)cyclohexane-1-carboxylic acid Openeye Name: 3,4-bis(decoxycarbonyl)cyclohexanecarboxylic acid CAS Name: 3,4-bis[decoxy(oxo)methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 3,4-bis(decoxycarbonyl)cyclohexane-1-carboxylic acid Traditional Name: 3,4-bis(decoxycarbonyl)cyclohexanecarboxylic acid Formula: C29H52O6 MolecularWeight: 496.71958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1CCC(CC1C(=O)OCCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCOC(=O)C1CCC(CC1C(=O)OCCCCCCCCCC)C(=O)O

InChI

InChI=1S/C29H52O6/c1-3-5-7-9-11-13-15-17-21-34-28(32)25-20-19-24(27(30)31)23-26(25)29(33)35-22-18-16-14-12-10-8-6-4-2/h24-26H,3-23H2,1-2H3,(H,30,31)