2-[2-(2,6-dimethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(2,6-dimethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-10-5-4-6-11(2)14(10)20-9-13(17)16-12(15(18)19)7-8-21-3/h4-6,12H,7-9H2,1-3H3,(H,16,17)(H,18,19)