methyl 2-[2-(4-methanoylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[2-(4-methanoylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[2-(4-formylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[2-(4-formylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-formylphenoxy)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(4-formylphenoxy)acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)COC1=CC=C(C=C1)C=O

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)COC1=CC=C(C=C1)C=O

InChI

InChI=1S/C15H19NO5S/c1-20-15(19)13(7-8-22-2)16-14(18)10-21-12-5-3-11(9-17)4-6-12/h3-6,9,13H,7-8,10H2,1-2H3,(H,16,18)