disodium 1-hexoxy-4-octoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: disodium 1-hexoxy-4-octoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: disodium 1-hexoxy-4-octoxy-1,4-dioxo-butane-2-sulfonic acid CAS Name: disodium 1-hexoxy-4-octoxy-1,4-dioxo-2-butanesulfonic acid IUPAC Name: disodium 1-hexoxy-4-octoxy-1,4-dioxobutane-2-sulfonic acid Traditional Name: disodium 1-hexoxy-1,4-diketo-4-octoxy-butane-2-sulfonic acid Formula: C18H34Na2O7S+2 MolecularWeight: 440.5029

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)O.[Na+].[Na+]

Isomeric SMILES

CCCCCCCCOC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)O.[Na+].[Na+]

InChI

InChI=1S/C18H34O7S.2Na/c1-3-5-7-9-10-12-13-24-17(19)15-16(26(21,22)23)18(20)25-14-11-8-6-4-2;;/h16H,3-15H2,1-2H3,(H,21,22,23);;/q;2*+1