2-dodecylsulfanyl-3-oxidanylidene-3-thiophen-2-yl-propanoic acid

Systemtic Name: 2-dodecylsulfanyl-3-oxidanylidene-3-thiophen-2-yl-propanoic acid Openeye Name: 2-dodecylsulfanyl-3-oxo-3-(2-thienyl)propanoic acid CAS Name: 2-(dodecylthio)-3-oxo-3-thiophen-2-ylpropanoic acid IUPAC Name: 2-dodecylsulfanyl-3-oxo-3-thiophen-2-ylpropanoic acid Traditional Name: 3-keto-2-(laurylthio)-3-(2-thienyl)propionic acid Formula: C19H30O3S2 MolecularWeight: 370.5697

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C(=O)C1=CC=CS1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCSC(C(=O)C1=CC=CS1)C(=O)O

InChI

InChI=1S/C19H30O3S2/c1-2-3-4-5-6-7-8-9-10-11-14-24-18(19(21)22)17(20)16-13-12-15-23-16/h12-13,15,18H,2-11,14H2,1H3,(H,21,22)