2-octadecylsulfanyl-2-oxidanyl-butanedioic acid

Systemtic Name: 2-octadecylsulfanyl-2-oxidanyl-butanedioic acid Openeye Name: 2-hydroxy-2-octadecylsulfanyl-butanedioic acid CAS Name: 2-hydroxy-2-(octadecylthio)butanedioic acid IUPAC Name: 2-hydroxy-2-octadecylsulfanylbutanedioic acid Traditional Name: 2-hydroxy-2-(stearylthio)succinic acid Formula: C22H42O5S MolecularWeight: 418.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C22H42O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-22(27,21(25)26)19-20(23)24/h27H,2-19H2,1H3,(H,23,24)(H,25,26)