2-(dibenzofuran-2-ylsulfonylamino)-6-(2-pyridin-3-ylethanoylamino)hexanoic acid

Systemtic Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-(2-pyridin-3-ylethanoylamino)hexanoic acid Openeye Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[2-(3-pyridyl)acetyl]amino]hexanoic acid CAS Name: 2-(2-dibenzofuranylsulfonylamino)-6-[[1-oxo-2-(3-pyridinyl)ethyl]amino]hexanoic acid IUPAC Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[(2-pyridin-3-ylacetyl)amino]hexanoic acid Traditional Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[2-(3-pyridyl)acetyl]amino]hexanoic acid Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)S(=O)(=O)NC(CCCCNC(=O)CC4=CN=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)S(=O)(=O)NC(CCCCNC(=O)CC4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C25H25N3O6S/c29-24(14-17-6-5-12-26-16-17)27-13-4-3-8-21(25(30)31)28-35(32,33)18-10-11-23-20(15-18)19-7-1-2-9-22(19)34-23/h1-2,5-7,9-12,15-16,21,28H,3-4,8,13-14H2,(H,27,29)(H,30,31)