3-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonylamino]propylazanium

Systemtic Name: 3-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonylamino]propylazanium Openeye Name: 3-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]propylammonium CAS Name: 3-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]propylammonium IUPAC Name: 3-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]propylazanium Traditional Name: 3-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]propylammonium Formula: C9H12F2N3O4S+ MolecularWeight: 296.271086

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1S(=O)(=O)NCCC[NH3+])F)F)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=CC(=C1S(=O)(=O)NCCC[NH3+])F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H11F2N3O4S/c10-6-4-7(11)9(5-8(6)14(15)16)19(17,18)13-3-1-2-12/h4-5,13H,1-3,12H2/p+1