methyl 4-chloranyl-3-[2-(2-oxidanylidene-1,3-thiazolidin-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-(2-oxidanylidene-1,3-thiazolidin-3-yl)ethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-(2-oxothiazolidin-3-yl)acetyl]amino]benzoate CAS Name: 4-chloro-3-[[1-oxo-2-(2-oxo-3-thiazolidinyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-(2-oxo-1,3-thiazolidin-3-yl)acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-(2-ketothiazolidin-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCSC2=O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCSC2=O

InChI

InChI=1S/C13H13ClN2O4S/c1-20-12(18)8-2-3-9(14)10(6-8)15-11(17)7-16-4-5-21-13(16)19/h2-3,6H,4-5,7H2,1H3,(H,15,17)