4-phenyldiazenyl-2-[8-(5-phenyldiazenyl-2-sulfo-phenyl)octa-3,5-diynyl]benzenesulfonic acid

Systemtic Name: 4-phenyldiazenyl-2-[8-(5-phenyldiazenyl-2-sulfo-phenyl)octa-3,5-diynyl]benzenesulfonic acid Openeye Name: 4-phenylazo-2-[8-(5-phenylazo-2-sulfo-phenyl)octa-3,5-diynyl]benzenesulfonic acid CAS Name: 4-phenyldiazenyl-2-[8-(5-phenyldiazenyl-2-sulfophenyl)octa-3,5-diynyl]benzenesulfonic acid IUPAC Name: 4-phenyldiazenyl-2-[8-(5-phenyldiazenyl-2-sulfophenyl)octa-3,5-diynyl]benzenesulfonic acid Traditional Name: 4-phenylazo-2-[8-(5-phenylazo-2-sulfo-phenyl)octa-3,5-diynyl]besylic acid Formula: C32H26N4O6S2 MolecularWeight: 626.70204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)S(=O)(=O)O)CCC#CC#CCCC3=C(C=CC(=C3)N=NC4=CC=CC=C4)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)S(=O)(=O)O)CCC#CC#CCCC3=C(C=CC(=C3)N=NC4=CC=CC=C4)S(=O)(=O)O

InChI

InChI=1S/C32H26N4O6S2/c37-43(38,39)31-21-19-29(35-33-27-15-9-5-10-16-27)23-25(31)13-7-3-1-2-4-8-14-26-24-30(20-22-32(26)44(40,41)42)36-34-28-17-11-6-12-18-28/h5-6,9-12,15-24H,7-8,13-14H2,(H,37,38,39)(H,40,41,42)