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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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