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3-[[4-[(E)-2-cyanoethenyl]sulfonylphenyl]sulfamoyl]benzoic acid

3-[[4-[(E)-2-cyanoethenyl]sulfonylphenyl]sulfamoyl]benzoic acid

Systemtic Name:3-[[4-[(E)-2-cyanoethenyl]sulfonylphenyl]sulfamoyl]benzoic acid
Openeye Name:3-[[4-[(E)-2-cyanovinyl]sulfonylphenyl]sulfamoyl]benzoic acid
CAS Name:3-[[4-[(E)-2-cyanoethenyl]sulfonylphenyl]sulfamoyl]benzoic acid
IUPAC Name:3-[[4-[(E)-2-cyanoethenyl]sulfonylphenyl]sulfamoyl]benzoic acid
Traditional Name:3-[[4-[(E)-2-cyanovinyl]sulfonylphenyl]sulfamoyl]benzoic acid
Formula: C16H12N2O6S2
MolecularWeight: 392.40628
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)C=CC#N)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)/C=C/C#N)C(=O)O


InChI

InChI=1S/C16H12N2O6S2/c17-9-2-10-25(21,22)14-7-5-13(6-8-14)18-26(23,24)15-4-1-3-12(11-15)16(19)20/h1-8,10-11,18H,(H,19,20)/b10-2+


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