2-[3-[2,6-bis(chloranyl)phenyl]-1,2-oxazol-5-yl]-2-methoxy-2-methylsulfanyl-ethanoic acid

Systemtic Name: 2-[3-[2,6-bis(chloranyl)phenyl]-1,2-oxazol-5-yl]-2-methoxy-2-methylsulfanyl-ethanoic acid Openeye Name: 2-[3-(2,6-dichlorophenyl)isoxazol-5-yl]-2-methoxy-2-methylsulfanyl-acetic acid CAS Name: 2-[3-(2,6-dichlorophenyl)-5-isoxazolyl]-2-methoxy-2-(methylthio)acetic acid IUPAC Name: 2-[3-(2,6-dichlorophenyl)-1,2-oxazol-5-yl]-2-methoxy-2-methylsulfanylacetic acid Traditional Name: 2-[3-(2,6-dichlorophenyl)isoxazol-5-yl]-2-methoxy-2-(methylthio)acetic acid Formula: C13H11Cl2NO4S MolecularWeight: 348.20174

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC(=NO1)C2=C(C=CC=C2Cl)Cl)(C(=O)O)SC

Isomeric SMILES

COC(C1=CC(=NO1)C2=C(C=CC=C2Cl)Cl)(C(=O)O)SC

InChI

InChI=1S/C13H11Cl2NO4S/c1-19-13(21-2,12(17)18)10-6-9(16-20-10)11-7(14)4-3-5-8(11)15/h3-6H,1-2H3,(H,17,18)