1,4-di(octan-2-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1,4-di(octan-2-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1,4-bis(1-methylheptoxy)-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1,4-di(octan-2-yloxy)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1,4-di(octan-2-yloxy)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1,4-diketo-1,4-bis(1-methylheptoxy)butane-2-sulfonic acid Formula: C20H38O7S MolecularWeight: 422.57652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)CC(C(=O)OC(C)CCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCC(C)OC(=O)CC(C(=O)OC(C)CCCCCC)S(=O)(=O)O

InChI

InChI=1S/C20H38O7S/c1-5-7-9-11-13-16(3)26-19(21)15-18(28(23,24)25)20(22)27-17(4)14-12-10-8-6-2/h16-18H,5-15H2,1-4H3,(H,23,24,25)