7-[2-[2,4-bis(chloranyl)phenoxy]ethyl-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[2-[2,4-bis(chloranyl)phenoxy]ethyl-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[2-(2,4-dichlorophenoxy)ethyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[2-(2,4-dichlorophenoxy)ethyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[2-(2,4-dichlorophenoxy)ethyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[2-(2,4-dichlorophenoxy)ethyl-mesyl-amino]enanthic acid Formula: C16H23Cl2NO5S MolecularWeight: 412.32852

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CCOC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CCOC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H23Cl2NO5S/c1-25(22,23)19(9-5-3-2-4-6-16(20)21)10-11-24-15-8-7-13(17)12-14(15)18/h7-8,12H,2-6,9-11H2,1H3,(H,20,21)