3-[2-(dibutylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(dibutylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(dibutylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(dibutylamino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(dibutylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(dibutylamino)-2-keto-ethyl]thio]propionic acid Formula: C13H25NO3S MolecularWeight: 275.4075

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CSCCC(=O)O

Isomeric SMILES

CCCCN(CCCC)C(=O)CSCCC(=O)O

InChI

InChI=1S/C13H25NO3S/c1-3-5-8-14(9-6-4-2)12(15)11-18-10-7-13(16)17/h3-11H2,1-2H3,(H,16,17)