7-[[5-[2,4-bis(chloranyl)phenoxy]-4-oxidanyl-pentyl]-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[[5-[2,4-bis(chloranyl)phenoxy]-4-oxidanyl-pentyl]-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[[5-(2,4-dichlorophenoxy)-4-hydroxy-pentyl]-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[[5-(2,4-dichlorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[[5-(2,4-dichlorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoic acid Traditional Name: 7-[[5-(2,4-dichlorophenoxy)-4-hydroxy-pentyl]-mesyl-amino]enanthic acid Formula: C19H29Cl2NO6S MolecularWeight: 470.40766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CCCC(COC1=C(C=C(C=C1)Cl)Cl)O

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CCCC(COC1=C(C=C(C=C1)Cl)Cl)O

InChI

InChI=1S/C19H29Cl2NO6S/c1-29(26,27)22(11-5-3-2-4-8-19(24)25)12-6-7-16(23)14-28-18-10-9-15(20)13-17(18)21/h9-10,13,16,23H,2-8,11-12,14H2,1H3,(H,24,25)