5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]pent-4-ynoic acid

Systemtic Name: 5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]pent-4-ynoic acid Openeye Name: 5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]pent-4-ynoic acid CAS Name: 5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]-4-pentynoic acid IUPAC Name: 5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]pent-4-ynoic acid Traditional Name: 5-phenyl-2-[[4-(2-phenylethynyl)phenyl]sulfonylamino]pent-4-ynoic acid Formula: C25H19NO4S MolecularWeight: 429.48766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H19NO4S/c27-25(28)24(13-7-12-20-8-3-1-4-9-20)26-31(29,30)23-18-16-22(17-19-23)15-14-21-10-5-2-6-11-21/h1-6,8-11,16-19,24,26H,13H2,(H,27,28)