N-(3-azanylpropyl)-4-fluoranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-azanylpropyl)-4-fluoranyl-3-nitro-benzenesulfonamide Openeye Name: N-(3-aminopropyl)-4-fluoro-3-nitro-benzenesulfonamide CAS Name: N-(3-aminopropyl)-4-fluoro-3-nitrobenzenesulfonamide IUPAC Name: N-(3-aminopropyl)-4-fluoro-3-nitrobenzenesulfonamide Traditional Name: N-(3-aminopropyl)-4-fluoro-3-nitro-benzenesulfonamide Formula: C9H12FN3O4S MolecularWeight: 277.272683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCCN)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCCN)[N+](=O)[O-])F

InChI

InChI=1S/C9H12FN3O4S/c10-8-3-2-7(6-9(8)13(14)15)18(16,17)12-5-1-4-11/h2-3,6,12H,1,4-5,11H2