2-[4-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethylsulfanyl]-2,6-bis(fluoranyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethylsulfanyl]-2,6-bis(fluoranyl)phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethylsulfanyl]-2,6-difluoro-phenoxy]acetic acid CAS Name: 2-[4-[2-[(4-chlorophenyl)sulfonyl-methylamino]ethylthio]-2,6-difluorophenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-chlorophenyl)sulfonyl-methylamino]ethylsulfanyl]-2,6-difluorophenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethylthio]-2,6-difluoro-phenoxy]acetic acid Formula: C17H16ClF2NO5S2 MolecularWeight: 451.892446

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCSC1=CC(=C(C(=C1)F)OCC(=O)O)F)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(CCSC1=CC(=C(C(=C1)F)OCC(=O)O)F)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClF2NO5S2/c1-21(28(24,25)13-4-2-11(18)3-5-13)6-7-27-12-8-14(19)17(15(20)9-12)26-10-16(22)23/h2-5,8-9H,6-7,10H2,1H3,(H,22,23)