2-dodecylsulfanyl-3-oxidanyl-butanedioic acid

Systemtic Name: 2-dodecylsulfanyl-3-oxidanyl-butanedioic acid Openeye Name: 2-dodecylsulfanyl-3-hydroxy-butanedioic acid CAS Name: 2-(dodecylthio)-3-hydroxybutanedioic acid IUPAC Name: 2-dodecylsulfanyl-3-hydroxybutanedioic acid Traditional Name: 2-hydroxy-3-(laurylthio)succinic acid Formula: C16H30O5S MolecularWeight: 334.4714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C(C(=O)O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCSC(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C16H30O5S/c1-2-3-4-5-6-7-8-9-10-11-12-22-14(16(20)21)13(17)15(18)19/h13-14,17H,2-12H2,1H3,(H,18,19)(H,20,21)