4-chloranyl-3-[2-(2-methoxyethylsulfanyl)ethanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-(2-methoxyethylsulfanyl)ethanoylamino]benzoic acid Openeye Name: 4-chloro-3-[[2-(2-methoxyethylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4-chloro-3-[[2-(2-methoxyethylthio)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[[2-(2-methoxyethylsulfanyl)acetyl]amino]benzoic acid Traditional Name: 4-chloro-3-[[2-(2-methoxyethylthio)acetyl]amino]benzoic acid Formula: C12H14ClNO4S MolecularWeight: 303.76186

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Descriptors Computed from Structure

Canonical SMILES:

COCCSCC(=O)NC1=C(C=CC(=C1)C(=O)O)Cl

Isomeric SMILES

COCCSCC(=O)NC1=C(C=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C12H14ClNO4S/c1-18-4-5-19-7-11(15)14-10-6-8(12(16)17)2-3-9(10)13/h2-3,6H,4-5,7H2,1H3,(H,14,15)(H,16,17)