2-octyl-2-sulfanyl-butanedioate

Systemtic Name: 2-octyl-2-sulfanyl-butanedioate Openeye Name: 2-octyl-2-sulfanyl-butanedioate CAS Name: 2-mercapto-2-octylbutanedioate IUPAC Name: 2-octyl-2-sulfanylbutanedioate Traditional Name: 2-mercapto-2-octyl-succinate Formula: C12H20O4S-2 MolecularWeight: 260.3498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(=O)[O-])(C(=O)[O-])S

Isomeric SMILES

CCCCCCCCC(CC(=O)[O-])(C(=O)[O-])S

InChI

InChI=1S/C12H22O4S/c1-2-3-4-5-6-7-8-12(17,11(15)16)9-10(13)14/h17H,2-9H2,1H3,(H,13,14)(H,15,16)/p-2