2-(dibenzofuran-2-ylsulfonylamino)-6-[2-(4-methoxyphenoxy)ethanoylamino]hexanoic acid

Systemtic Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[2-(4-methoxyphenoxy)ethanoylamino]hexanoic acid Openeye Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[2-(4-methoxyphenoxy)acetyl]amino]hexanoic acid CAS Name: 2-(2-dibenzofuranylsulfonylamino)-6-[[2-(4-methoxyphenoxy)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[2-(4-methoxyphenoxy)acetyl]amino]hexanoic acid Traditional Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[2-(4-methoxyphenoxy)acetyl]amino]hexanoic acid Formula: C27H28N2O8S MolecularWeight: 540.58482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)NCCCCC(C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)NCCCCC(C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

InChI

InChI=1S/C27H28N2O8S/c1-35-18-9-11-19(12-10-18)36-17-26(30)28-15-5-4-7-23(27(31)32)29-38(33,34)20-13-14-25-22(16-20)21-6-2-3-8-24(21)37-25/h2-3,6,8-14,16,23,29H,4-5,7,15,17H2,1H3,(H,28,30)(H,31,32)