1,4-bis(3-methylbutoxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1,4-bis(3-methylbutoxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1,4-diisopentyloxy-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1,4-bis(3-methylbutoxy)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1,4-bis(3-methylbutoxy)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1,4-diisoamoxy-1,4-diketo-butane-2-sulfonic acid Formula: C14H26O7S MolecularWeight: 338.41704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC(C(=O)OCCC(C)C)S(=O)(=O)O

Isomeric SMILES

CC(C)CCOC(=O)CC(C(=O)OCCC(C)C)S(=O)(=O)O

InChI

InChI=1S/C14H26O7S/c1-10(2)5-7-20-13(15)9-12(22(17,18)19)14(16)21-8-6-11(3)4/h10-12H,5-9H2,1-4H3,(H,17,18,19)