2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]-3-hydroxy-propanoic acid CAS Name: 2-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]-3-hydroxypropanoic acid IUPAC Name: 2-[(2,4-difluoro-5-nitrophenyl)sulfonylamino]-3-hydroxypropanoic acid Traditional Name: 2-[(2,4-difluoro-5-nitro-phenyl)sulfonylamino]-3-hydroxy-propionic acid Formula: C9H8F2N2O7S MolecularWeight: 326.230826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8F2N2O7S/c10-4-1-5(11)8(2-7(4)13(17)18)21(19,20)12-6(3-14)9(15)16/h1-2,6,12,14H,3H2,(H,15,16)