sodium 1,4-bis(11-methyldodecoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate

Systemtic Name: sodium 1,4-bis(11-methyldodecoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate Openeye Name: sodium 1,4-bis(11-methyldodecoxy)-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 1,4-bis(11-methyldodecoxy)-1,4-dioxo-2-butanesulfonate IUPAC Name: sodium 1,4-bis(11-methyldodecoxy)-1,4-dioxobutane-2-sulfonate Traditional Name: sodium 1,4-diketo-1,4-bis(11-methyldodecoxy)butane-2-sulfonate Formula: C30H57NaO7S MolecularWeight: 584.82415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H58O7S.Na/c1-26(2)21-17-13-9-5-7-11-15-19-23-36-29(31)25-28(38(33,34)35)30(32)37-24-20-16-12-8-6-10-14-18-22-27(3)4;/h26-28H,5-25H2,1-4H3,(H,33,34,35);/q;+1/p-1