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

Systemtic Name: 2-[2-(2-tert-butyl-4-methoxy-phenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(2-tert-butyl-4-methoxy-phenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(2-tert-butyl-4-methoxyphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(2-tert-butyl-4-methoxyphenoxy)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(2-tert-butyl-4-methoxy-phenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C18H27NO5S MolecularWeight: 369.47568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO5S/c1-18(2,3)13-10-12(23-4)6-7-15(13)24-11-16(20)19-14(17(21)22)8-9-25-5/h6-7,10,14H,8-9,11H2,1-5H3,(H,19,20)(H,21,22)