4-(2-fluoranyl-4-nitro-6-sulfamoyl-phenoxy)butanoic acid

Systemtic Name: 4-(2-fluoranyl-4-nitro-6-sulfamoyl-phenoxy)butanoic acid Openeye Name: 4-(2-fluoro-4-nitro-6-sulfamoyl-phenoxy)butanoic acid CAS Name: 4-(2-fluoro-4-nitro-6-sulfamoylphenoxy)butanoic acid IUPAC Name: 4-(2-fluoro-4-nitro-6-sulfamoylphenoxy)butanoic acid Traditional Name: 4-(2-fluoro-4-nitro-6-sulfamoyl-phenoxy)butyric acid Formula: C10H11FN2O7S MolecularWeight: 322.266943

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1F)OCCCC(=O)O)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1F)OCCCC(=O)O)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C10H11FN2O7S/c11-7-4-6(13(16)17)5-8(21(12,18)19)10(7)20-3-1-2-9(14)15/h4-5H,1-3H2,(H,14,15)(H2,12,18,19)