4,4-dimethyl-2-(2-oxidanylidene-2-thiomorpholin-4-yl-ethyl)pentanoic acid

Systemtic Name: 4,4-dimethyl-2-(2-oxidanylidene-2-thiomorpholin-4-yl-ethyl)pentanoic acid Openeye Name: 4,4-dimethyl-2-(2-oxo-2-thiomorpholino-ethyl)pentanoic acid CAS Name: 4,4-dimethyl-2-(2-oxo-2-thiomorpholin-4-ylethyl)pentanoic acid IUPAC Name: 4,4-dimethyl-2-(2-oxo-2-thiomorpholin-4-ylethyl)pentanoic acid Traditional Name: 2-(2-keto-2-thiomorpholino-ethyl)-4,4-dimethyl-valeric acid Formula: C13H23NO3S MolecularWeight: 273.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(CC(=O)N1CCSCC1)C(=O)O

Isomeric SMILES

CC(C)(C)CC(CC(=O)N1CCSCC1)C(=O)O

InChI

InChI=1S/C13H23NO3S/c1-13(2,3)9-10(12(16)17)8-11(15)14-4-6-18-7-5-14/h10H,4-9H2,1-3H3,(H,16,17)