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

Systemtic Name: sodium 1,4-diheptoxy-1,4-bis(oxidanylidene)butane-2-sulfonate Openeye Name: sodium 1,4-diheptoxy-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 1,4-diheptoxy-1,4-dioxo-2-butanesulfonate IUPAC Name: sodium 1,4-diheptoxy-1,4-dioxobutane-2-sulfonate Traditional Name: sodium 1,4-diheptoxy-1,4-diketo-butane-2-sulfonate Formula: C18H33NaO7S MolecularWeight: 416.50519

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O7S.Na/c1-3-5-7-9-11-13-24-17(19)15-16(26(21,22)23)18(20)25-14-12-10-8-6-4-2;/h16H,3-15H2,1-2H3,(H,21,22,23);/q;+1/p-1