2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-[4-(1,1-dimethylpropyl)phenoxy]acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[4-(2-methylbutan-2-yl)phenoxy]-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(4-tert-amylphenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO4S/c1-5-18(2,3)13-6-8-14(9-7-13)23-12-16(20)19-15(17(21)22)10-11-24-4/h6-9,15H,5,10-12H2,1-4H3,(H,19,20)(H,21,22)