methyl (2R)-2-[2-(5-chloranyl-2-methoxy-phenyl)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[2-(5-chloranyl-2-methoxy-phenyl)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[2-(5-chloro-2-methoxy-phenyl)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[2-(5-chloro-2-methoxyphenyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-(5-chloro-2-methoxy-phenyl)acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C15H20ClNO4S MolecularWeight: 345.8416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CC(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C15H20ClNO4S/c1-20-13-5-4-11(16)8-10(13)9-14(18)17-12(6-7-22-3)15(19)21-2/h4-5,8,12H,6-7,9H2,1-3H3,(H,17,18)/t12-/m1/s1