2-[4-[[5-(4-fluoranylphenoxy)-4-oxidanyl-pentyl]-methylsulfonyl-amino]butoxy]ethanoic acid

Systemtic Name: 2-[4-[[5-(4-fluoranylphenoxy)-4-oxidanyl-pentyl]-methylsulfonyl-amino]butoxy]ethanoic acid Openeye Name: 2-[4-[[5-(4-fluorophenoxy)-4-hydroxy-pentyl]-methylsulfonyl-amino]butoxy]acetic acid CAS Name: 2-[4-[[5-(4-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]butoxy]acetic acid IUPAC Name: 2-[4-[[5-(4-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]butoxy]acetic acid Traditional Name: 2-[4-[[5-(4-fluorophenoxy)-4-hydroxy-pentyl]-mesyl-amino]butoxy]acetic acid Formula: C18H28FNO7S MolecularWeight: 421.480823

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCOCC(=O)O)CCCC(COC1=CC=C(C=C1)F)O

Isomeric SMILES

CS(=O)(=O)N(CCCCOCC(=O)O)CCCC(COC1=CC=C(C=C1)F)O

InChI

InChI=1S/C18H28FNO7S/c1-28(24,25)20(10-2-3-12-26-14-18(22)23)11-4-5-16(21)13-27-17-8-6-15(19)7-9-17/h6-9,16,21H,2-5,10-14H2,1H3,(H,22,23)