2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(2-tert-butyl-4-ethyl-phenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(2-tert-butyl-4-ethylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(2-tert-butyl-4-ethylphenoxy)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(2-tert-butyl-4-ethyl-phenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C19H29NO4S MolecularWeight: 367.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(CCSC)C(=O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(CCSC)C(=O)O)C(C)(C)C

InChI

InChI=1S/C19H29NO4S/c1-6-13-7-8-16(14(11-13)19(2,3)4)24-12-17(21)20-15(18(22)23)9-10-25-5/h7-8,11,15H,6,9-10,12H2,1-5H3,(H,20,21)(H,22,23)