N4-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide Openeye Name: N4-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide CAS Name: N4-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide Traditional Name: N'-[3-(2-phenylethynyl)phenyl]benzene-1,4-disulfonamide Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H16N2O4S2/c21-27(23,24)19-11-13-20(14-12-19)28(25,26)22-18-8-4-7-17(15-18)10-9-16-5-2-1-3-6-16/h1-8,11-15,22H,(H2,21,23,24)