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

Systemtic Name: 4-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonylamino]butanoate Openeye Name: 4-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]butanoate CAS Name: 4-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]butanoate IUPAC Name: 4-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]butanoate Traditional Name: 4-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]butyrate Formula: C10H9F2N2O6S- MolecularWeight: 323.250066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10F2N2O6S/c11-6-4-7(12)9(5-8(6)14(17)18)21(19,20)13-3-1-2-10(15)16/h4-5,13H,1-3H2,(H,15,16)/p-1