3-[bis(cyanomethyl)sulfamoyl]-2,6-bis(fluoranyl)benzoic acid

Systemtic Name: 3-[bis(cyanomethyl)sulfamoyl]-2,6-bis(fluoranyl)benzoic acid Openeye Name: 3-[bis(cyanomethyl)sulfamoyl]-2,6-difluoro-benzoic acid CAS Name: 3-[bis(cyanomethyl)sulfamoyl]-2,6-difluorobenzoic acid IUPAC Name: 3-[bis(cyanomethyl)sulfamoyl]-2,6-difluorobenzoic acid Traditional Name: 3-[bis(cyanomethyl)sulfamoyl]-2,6-difluoro-benzoic acid Formula: C11H7F2N3O4S MolecularWeight: 315.252786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1F)C(=O)O)F)S(=O)(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=C(C(=C1F)C(=O)O)F)S(=O)(=O)N(CC#N)CC#N

InChI

InChI=1S/C11H7F2N3O4S/c12-7-1-2-8(10(13)9(7)11(17)18)21(19,20)16(5-3-14)6-4-15/h1-2H,5-6H2,(H,17,18)