sodium 1,4-bis(oxidanylidene)-1,4-dipentoxy-butane-2-sulfonate

Systemtic Name: sodium 1,4-bis(oxidanylidene)-1,4-dipentoxy-butane-2-sulfonate Openeye Name: sodium 1,4-dioxo-1,4-dipentoxy-butane-2-sulfonate CAS Name: sodium 1,4-dioxo-1,4-dipentoxy-2-butanesulfonate IUPAC Name: sodium 1,4-dioxo-1,4-dipentoxybutane-2-sulfonate Traditional Name: sodium 1,4-diamoxy-1,4-diketo-butane-2-sulfonate Formula: C14H25NaO7S MolecularWeight: 360.39887

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC(C(=O)OCCCCC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCOC(=O)CC(C(=O)OCCCCC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H26O7S.Na/c1-3-5-7-9-20-13(15)11-12(22(17,18)19)14(16)21-10-8-6-4-2;/h12H,3-11H2,1-2H3,(H,17,18,19);/q;+1/p-1