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

Systemtic Name: sodium 1-dodecoxy-4-oxidanyl-1,4-bis(oxidanylidene)butane-2-sulfonate Openeye Name: sodium 1-dodecoxy-4-hydroxy-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 1-dodecoxy-4-hydroxy-1,4-dioxo-2-butanesulfonate IUPAC Name: sodium 1-dodecoxy-4-hydroxy-1,4-dioxobutane-2-sulfonate Traditional Name: sodium 4-hydroxy-1,4-diketo-1-lauryloxy-butane-2-sulfonate Formula: C16H29NaO7S MolecularWeight: 388.45203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H30O7S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-23-16(19)14(13-15(17)18)24(20,21)22;/h14H,2-13H2,1H3,(H,17,18)(H,20,21,22);/q;+1/p-1