disodium 2-octadecoxy-3-oxidanyl-butanedioate

Systemtic Name: disodium 2-octadecoxy-3-oxidanyl-butanedioate Openeye Name: disodium 2-hydroxy-3-octadecoxy-butanedioate CAS Name: disodium 2-hydroxy-3-octadecoxybutanedioate IUPAC Name: disodium 2-hydroxy-3-octadecoxybutanedioate Traditional Name: disodium 2-hydroxy-3-stearyloxy-succinate Formula: C22H40Na2O6 MolecularWeight: 446.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C22H42O6.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-20(22(26)27)19(23)21(24)25;;/h19-20,23H,2-18H2,1H3,(H,24,25)(H,26,27);;/q;2*+1/p-2