methyl 2-[[2-[(4-chloranyl-2-ethanoyl-phenoxy)methyl]morpholin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[2-[(4-chloranyl-2-ethanoyl-phenoxy)methyl]morpholin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[2-[(2-acetyl-4-chloro-phenoxy)methyl]morpholine-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-[(2-acetyl-4-chlorophenoxy)methyl]-4-morpholinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-acetyl-4-chlorophenoxy)methyl]morpholine-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-[(2-acetyl-4-chloro-phenoxy)methyl]morpholine-4-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C20H27ClN2O6S MolecularWeight: 458.95618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)Cl)OCC2CN(CCO2)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)Cl)OCC2CN(CCO2)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C20H27ClN2O6S/c1-13(24)16-10-14(21)4-5-18(16)29-12-15-11-23(7-8-28-15)20(26)22-17(6-9-30-3)19(25)27-2/h4-5,10,15,17H,6-9,11-12H2,1-3H3,(H,22,26)