1,4-di(hexadecan-7-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1,4-di(hexadecan-7-yloxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1,4-bis(1-hexyldecoxy)-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1,4-di(hexadecan-7-yloxy)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1,4-di(hexadecan-7-yloxy)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1,4-bis(1-hexyldecoxy)-1,4-diketo-butane-2-sulfonic acid Formula: C36H70O7S MolecularWeight: 647.0018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCC)OC(=O)CC(C(=O)OC(CCCCCC)CCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC(CCCCCC)OC(=O)CC(C(=O)OC(CCCCCC)CCCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C36H70O7S/c1-5-9-13-17-19-21-25-28-32(27-23-15-11-7-3)42-35(37)31-34(44(39,40)41)36(38)43-33(29-24-16-12-8-4)30-26-22-20-18-14-10-6-2/h32-34H,5-31H2,1-4H3,(H,39,40,41)