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

Systemtic Name: 3-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(diethylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(diethylamino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(diethylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(diethylamino)-2-keto-ethyl]thio]propionic acid Formula: C9H17NO3S MolecularWeight: 219.30118

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSCCC(=O)O

Isomeric SMILES

CCN(CC)C(=O)CSCCC(=O)O

InChI

InChI=1S/C9H17NO3S/c1-3-10(4-2)8(11)7-14-6-5-9(12)13/h3-7H2,1-2H3,(H,12,13)