3-[bis(cyanomethyl)sulfamoyl]-5-chloranyl-2-fluoranyl-benzoic acid

Systemtic Name: 3-[bis(cyanomethyl)sulfamoyl]-5-chloranyl-2-fluoranyl-benzoic acid Openeye Name: 3-[bis(cyanomethyl)sulfamoyl]-5-chloro-2-fluoro-benzoic acid CAS Name: 3-[bis(cyanomethyl)sulfamoyl]-5-chloro-2-fluorobenzoic acid IUPAC Name: 3-[bis(cyanomethyl)sulfamoyl]-5-chloro-2-fluorobenzoic acid Traditional Name: 3-[bis(cyanomethyl)sulfamoyl]-5-chloro-2-fluoro-benzoic acid Formula: C11H7ClFN3O4S MolecularWeight: 331.707383

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)N(CC#N)CC#N)F)C(=O)O)Cl

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)N(CC#N)CC#N)F)C(=O)O)Cl

InChI

InChI=1S/C11H7ClFN3O4S/c12-7-5-8(11(17)18)10(13)9(6-7)21(19,20)16(3-1-14)4-2-15/h5-6H,3-4H2,(H,17,18)