(2R)-2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-4-(methylthio)butyrate Formula: C15H19ClNO4S- MolecularWeight: 344.83366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C15H20ClNO4S/c1-9-6-11(7-10(2)14(9)16)21-8-13(18)17-12(15(19)20)4-5-22-3/h6-7,12H,4-5,8H2,1-3H3,(H,17,18)(H,19,20)/p-1/t12-/m1/s1