2-octadecylsulfanylbutanedioate

Systemtic Name: 2-octadecylsulfanylbutanedioate Openeye Name: 2-octadecylsulfanylbutanedioate CAS Name: 2-(octadecylthio)butanedioate IUPAC Name: 2-octadecylsulfanylbutanedioate Traditional Name: 2-(stearylthio)succinate Formula: C22H40O4S-2 MolecularWeight: 400.6156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H42O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27-20(22(25)26)19-21(23)24/h20H,2-19H2,1H3,(H,23,24)(H,25,26)/p-2