3-[(4-fluoranyl-2-nitro-phenyl)sulfonylamino]propylazanium

Systemtic Name: 3-[(4-fluoranyl-2-nitro-phenyl)sulfonylamino]propylazanium Openeye Name: 3-[(4-fluoro-2-nitro-phenyl)sulfonylamino]propylammonium CAS Name: 3-[(4-fluoro-2-nitrophenyl)sulfonylamino]propylammonium IUPAC Name: 3-[(4-fluoro-2-nitrophenyl)sulfonylamino]propylazanium Traditional Name: 3-[(4-fluoro-2-nitro-phenyl)sulfonylamino]propylammonium Formula: C9H13FN3O4S+ MolecularWeight: 278.280623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)[N+](=O)[O-])S(=O)(=O)NCCC[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1F)[N+](=O)[O-])S(=O)(=O)NCCC[NH3+]

InChI

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