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

Systemtic Name: 3,4-bis(icosoxycarbonyl)cyclohexane-1-carboxylic acid Openeye Name: 3,4-bis(icosoxycarbonyl)cyclohexanecarboxylic acid CAS Name: 3,4-bis[eicosoxy(oxo)methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 3,4-bis(icosoxycarbonyl)cyclohexane-1-carboxylic acid Traditional Name: 3,4-bis(arachyloxycarbonyl)cyclohexanecarboxylic acid Formula: C49H92O6 MolecularWeight: 777.25118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(=O)C1CCC(CC1C(=O)OCCCCCCCCCCCCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(=O)C1CCC(CC1C(=O)OCCCCCCCCCCCCCCCCCCCC)C(=O)O

InChI

InChI=1S/C49H92O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-41-54-48(52)45-40-39-44(47(50)51)43-46(45)49(53)55-42-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h44-46H,3-43H2,1-2H3,(H,50,51)