2-[[2,5-bis(fluoranyl)-4-nitro-phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[2,5-bis(fluoranyl)-4-nitro-phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[(2,5-difluoro-4-nitro-benzoyl)amino]pentanedioic acid CAS Name: 2-[[(2,5-difluoro-4-nitrophenyl)-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[(2,5-difluoro-4-nitrobenzoyl)amino]pentanedioic acid Traditional Name: 2-[(2,5-difluoro-4-nitro-benzoyl)amino]glutaric acid Formula: C12H10F2N2O7 MolecularWeight: 332.213806

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)[N+](=O)[O-])F)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1F)[N+](=O)[O-])F)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C12H10F2N2O7/c13-6-4-9(16(22)23)7(14)3-5(6)11(19)15-8(12(20)21)1-2-10(17)18/h3-4,8H,1-2H2,(H,15,19)(H,17,18)(H,20,21)