1,4-bis(2,6-dimethylheptan-4-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1,4-bis(2,6-dimethylheptan-4-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1,4-bis(1-isobutyl-3-methyl-butoxy)-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1,4-bis(2,6-dimethylheptan-4-yloxy)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1,4-bis(2,6-dimethylheptan-4-yloxy)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1,4-bis(1-isobutyl-3-methyl-butoxy)-1,4-diketo-butane-2-sulfonic acid Formula: C22H42O7S MolecularWeight: 450.62968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42O7S/c1-14(2)9-18(10-15(3)4)28-21(23)13-20(30(25,26)27)22(24)29-19(11-16(5)6)12-17(7)8/h14-20H,9-13H2,1-8H3,(H,25,26,27)