methyl (2R)-4-methylsulfanyl-2-[2-(2,4,6-trimethylphenoxy)ethanoylamino]butanoate

Systemtic Name: methyl (2R)-4-methylsulfanyl-2-[2-(2,4,6-trimethylphenoxy)ethanoylamino]butanoate Openeye Name: methyl (2R)-4-methylsulfanyl-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butanoate CAS Name: (2R)-4-(methylthio)-2-[[1-oxo-2-(2,4,6-trimethylphenoxy)ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R)-4-methylsulfanyl-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butanoate Traditional Name: (2R)-4-(methylthio)-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]butyric acid methyl ester Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)N[C@H](CCSC)C(=O)OC)C

InChI

InChI=1S/C17H25NO4S/c1-11-8-12(2)16(13(3)9-11)22-10-15(19)18-14(6-7-23-5)17(20)21-4/h8-9,14H,6-7,10H2,1-5H3,(H,18,19)/t14-/m1/s1