2-(dibenzofuran-2-ylsulfonylamino)-6-[[(E)-3-phenylprop-2-enoyl]amino]hexanoic acid

Systemtic Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[(E)-3-phenylprop-2-enoyl]amino]hexanoic acid Openeye Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[(E)-3-phenylprop-2-enoyl]amino]hexanoic acid CAS Name: 2-(2-dibenzofuranylsulfonylamino)-6-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]hexanoic acid IUPAC Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[(E)-3-phenylprop-2-enoyl]amino]hexanoic acid Traditional Name: 2-(dibenzofuran-2-ylsulfonylamino)-6-[[(E)-3-phenylacryloyl]amino]hexanoic acid Formula: C27H26N2O6S MolecularWeight: 506.57014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O6S/c30-26(16-13-19-8-2-1-3-9-19)28-17-7-6-11-23(27(31)32)29-36(33,34)20-14-15-25-22(18-20)21-10-4-5-12-24(21)35-25/h1-5,8-10,12-16,18,23,29H,6-7,11,17H2,(H,28,30)(H,31,32)/b16-13+