6-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid

Systemtic Name: 6-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid Openeye Name: 6-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid CAS Name: 6-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]-2-(2-dibenzofuranylsulfonylamino)hexanoic acid IUPAC Name: 6-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid Traditional Name: 6-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-2-(dibenzofuran-2-ylsulfonylamino)hexanoic acid Formula: C28H29ClN2O7S MolecularWeight: 573.05706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCCCCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C(=O)NCCCCC(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H29ClN2O7S/c1-28(2,38-19-12-10-18(29)11-13-19)27(34)30-16-6-5-8-23(26(32)33)31-39(35,36)20-14-15-25-22(17-20)21-7-3-4-9-24(21)37-25/h3-4,7,9-15,17,23,31H,5-6,8,16H2,1-2H3,(H,30,34)(H,32,33)