[(2-chlorophenyl)-(3-methoxy-5-oxidanylidene-2H-furan-4-yl)methyl] 2-acetamido-4-methylsulfanyl-butanoate

Systemtic Name: [(2-chlorophenyl)-(3-methoxy-5-oxidanylidene-2H-furan-4-yl)methyl] 2-acetamido-4-methylsulfanyl-butanoate Openeye Name: [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-4-yl)methyl] 2-acetamido-4-methylsulfanyl-butanoate CAS Name: 2-acetamido-4-(methylthio)butanoic acid [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-4-yl)methyl] ester IUPAC Name: [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-4-yl)methyl] 2-acetamido-4-methylsulfanylbutanoate Traditional Name: 2-acetamido-4-(methylthio)butyric acid [(2-chlorophenyl)-(5-keto-3-methoxy-2H-furan-4-yl)methyl] ester Formula: C19H22ClNO6S MolecularWeight: 427.89908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)OC(C1=CC=CC=C1Cl)C2=C(COC2=O)OC

Isomeric SMILES

CC(=O)NC(CCSC)C(=O)OC(C1=CC=CC=C1Cl)C2=C(COC2=O)OC

InChI

InChI=1S/C19H22ClNO6S/c1-11(22)21-14(8-9-28-3)18(23)27-17(12-6-4-5-7-13(12)20)16-15(25-2)10-26-19(16)24/h4-7,14,17H,8-10H2,1-3H3,(H,21,22)