4-chloranyl-3-(2-methylsulfanylethanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(2-methylsulfanylethanoylamino)benzoic acid Openeye Name: 4-chloro-3-[(2-methylsulfanylacetyl)amino]benzoic acid CAS Name: 4-chloro-3-[[2-(methylthio)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(2-methylsulfanylacetyl)amino]benzoic acid Traditional Name: 4-chloro-3-[[2-(methylthio)acetyl]amino]benzoic acid Formula: C10H10ClNO3S MolecularWeight: 259.7093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNO3S/c1-16-5-9(13)12-8-4-6(10(14)15)2-3-7(8)11/h2-4H,5H2,1H3,(H,12,13)(H,14,15)