2-[4-(diethylamino)-4-oxidanylidene-butyl]sulfanylpropanoic acid

Systemtic Name: 2-[4-(diethylamino)-4-oxidanylidene-butyl]sulfanylpropanoic acid Openeye Name: 2-[4-(diethylamino)-4-oxo-butyl]sulfanylpropanoic acid CAS Name: 2-[[4-(diethylamino)-4-oxobutyl]thio]propanoic acid IUPAC Name: 2-[4-(diethylamino)-4-oxobutyl]sulfanylpropanoic acid Traditional Name: 2-[[4-(diethylamino)-4-keto-butyl]thio]propionic acid Formula: C11H21NO3S MolecularWeight: 247.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC(C)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)CCCSC(C)C(=O)O

InChI

InChI=1S/C11H21NO3S/c1-4-12(5-2)10(13)7-6-8-16-9(3)11(14)15/h9H,4-8H2,1-3H3,(H,14,15)