2-[bis(cyanomethyl)sulfamoyl]benzoate

Systemtic Name: 2-[bis(cyanomethyl)sulfamoyl]benzoate Openeye Name: 2-[bis(cyanomethyl)sulfamoyl]benzoate CAS Name: 2-[bis(cyanomethyl)sulfamoyl]benzoate IUPAC Name: 2-[bis(cyanomethyl)sulfamoyl]benzoate Traditional Name: 2-[bis(cyanomethyl)sulfamoyl]benzoate Formula: C11H8N3O4S- MolecularWeight: 278.26392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])S(=O)(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])S(=O)(=O)N(CC#N)CC#N

InChI

InChI=1S/C11H9N3O4S/c12-5-7-14(8-6-13)19(17,18)10-4-2-1-3-9(10)11(15)16/h1-4H,7-8H2,(H,15,16)/p-1