disodium 4-dodecoxy-3-ethoxy-4-oxidanylidene-3-sulfonato-butanoate

Systemtic Name: disodium 4-dodecoxy-3-ethoxy-4-oxidanylidene-3-sulfonato-butanoate Openeye Name: disodium 4-dodecoxy-3-ethoxy-4-oxo-3-sulfonato-butanoate CAS Name: disodium 4-dodecoxy-3-ethoxy-4-oxo-3-sulfonatobutanoate IUPAC Name: disodium 4-dodecoxy-3-ethoxy-4-oxo-3-sulfonatobutanoate Traditional Name: disodium 3-ethoxy-4-keto-4-lauryloxy-3-sulfonato-butyrate Formula: C18H32Na2O8S MolecularWeight: 454.48642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(CC(=O)[O-])(OCC)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(CC(=O)[O-])(OCC)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H34O8S.2Na/c1-3-5-6-7-8-9-10-11-12-13-14-25-17(21)18(26-4-2,15-16(19)20)27(22,23)24;;/h3-15H2,1-2H3,(H,19,20)(H,22,23,24);;/q;2*+1/p-2