1,4-bis(2-ethyloctadecoxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1,4-bis(2-ethyloctadecoxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1,4-bis(2-ethyloctadecoxy)-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1,4-bis(2-ethyloctadecoxy)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1,4-bis(2-ethyloctadecoxy)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1,4-bis(2-ethyloctadecoxy)-1,4-diketo-butane-2-sulfonic acid Formula: C44H86O7S MolecularWeight: 759.21444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCCCCCCCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCCCCCCCCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C44H86O7S/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40(7-3)38-50-43(45)37-42(52(47,48)49)44(46)51-39-41(8-4)36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h40-42H,5-39H2,1-4H3,(H,47,48,49)