4-chloranyl-2-(2-methoxycarbonylsulfanylethanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-2-(2-methoxycarbonylsulfanylethanoylamino)benzoic acid Openeye Name: 4-chloro-2-[(2-methoxycarbonylsulfanylacetyl)amino]benzoic acid CAS Name: 4-chloro-2-[[2-(methoxycarbonylthio)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[(2-methoxycarbonylsulfanylacetyl)amino]benzoic acid Traditional Name: 2-[[2-(carbomethoxythio)acetyl]amino]-4-chloro-benzoic acid Formula: C11H10ClNO5S MolecularWeight: 303.7188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)SCC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O

Isomeric SMILES

COC(=O)SCC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O

InChI

InChI=1S/C11H10ClNO5S/c1-18-11(17)19-5-9(14)13-8-4-6(12)2-3-7(8)10(15)16/h2-4H,5H2,1H3,(H,13,14)(H,15,16)