methyl 4-[2-(2-hydroxyethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2-hydroxyethylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-(2-hydroxyethylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-hydroxyethylthio)acetyl]amino]benzoic acid methyl ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSCCO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSCCO

InChI

InChI=1S/C12H15NO4S/c1-17-12(16)9-2-4-10(5-3-9)13-11(15)8-18-7-6-14/h2-5,14H,6-8H2,1H3,(H,13,15)