2-[(2-fluoranyl-5-nitro-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(2-fluoranyl-5-nitro-phenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(2-fluoro-5-nitro-phenyl)sulfonylamino]butanoic acid CAS Name: 2-[(2-fluoro-5-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(2-fluoro-5-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(2-fluoro-5-nitro-phenyl)sulfonylamino]butyric acid Formula: C10H11FN2O6S MolecularWeight: 306.267543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])F

Isomeric SMILES

CCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])F

InChI

InChI=1S/C10H11FN2O6S/c1-2-8(10(14)15)12-20(18,19)9-5-6(13(16)17)3-4-7(9)11/h3-5,8,12H,2H2,1H3,(H,14,15)