methyl 4-chloranyl-2-(2-methoxycarbonylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 4-chloranyl-2-(2-methoxycarbonylsulfanylethanoylamino)benzoate Openeye Name: methyl 4-chloro-2-[(2-methoxycarbonylsulfanylacetyl)amino]benzoate CAS Name: 4-chloro-2-[[2-(methoxycarbonylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[(2-methoxycarbonylsulfanylacetyl)amino]benzoate Traditional Name: 2-[[2-(carbomethoxythio)acetyl]amino]-4-chloro-benzoic acid methyl ester Formula: C12H12ClNO5S MolecularWeight: 317.74538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CSC(=O)OC

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CSC(=O)OC

InChI

InChI=1S/C12H12ClNO5S/c1-18-11(16)8-4-3-7(13)5-9(8)14-10(15)6-20-12(17)19-2/h3-5H,6H2,1-2H3,(H,14,15)