2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2-chloro-5-methylsulfanyl-benzoyl)-methyl-amino]acetic acid CAS Name: 2-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(2-chloro-5-methylsulfanylbenzoyl)-methylamino]acetic acid Traditional Name: 2-[[2-chloro-5-(methylthio)benzoyl]-methyl-amino]acetic acid Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=C(C=CC(=C1)SC)Cl

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=C(C=CC(=C1)SC)Cl

InChI

InChI=1S/C11H12ClNO3S/c1-13(6-10(14)15)11(16)8-5-7(17-2)3-4-9(8)12/h3-5H,6H2,1-2H3,(H,14,15)