2-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]pentanedioate

Systemtic Name: 2-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]pentanedioate Openeye Name: 2-[(2-fluoro-4-nitro-benzoyl)amino]pentanedioate CAS Name: 2-[[(2-fluoro-4-nitrophenyl)-oxomethyl]amino]pentanedioate IUPAC Name: 2-[(2-fluoro-4-nitrobenzoyl)amino]pentanedioate Traditional Name: 2-[(2-fluoro-4-nitro-benzoyl)amino]glutarate Formula: C12H9FN2O7-2 MolecularWeight: 312.207463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11FN2O7/c13-8-5-6(15(21)22)1-2-7(8)11(18)14-9(12(19)20)3-4-10(16)17/h1-2,5,9H,3-4H2,(H,14,18)(H,16,17)(H,19,20)/p-2