2-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]pentanedioic acid

Systemtic Name: 2-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]pentanedioic acid Openeye Name: 2-[[2-hydroxy-1-(2-nitrophenyl)-2-oxo-ethyl]amino]pentanedioic acid CAS Name: 2-[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]amino]pentanedioic acid IUPAC Name: 2-[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]amino]pentanedioic acid Traditional Name: 2-[[2-hydroxy-2-keto-1-(2-nitrophenyl)ethyl]amino]glutaric acid Formula: C13H14N2O8 MolecularWeight: 326.25886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O8/c16-10(17)6-5-8(12(18)19)14-11(13(20)21)7-3-1-2-4-9(7)15(22)23/h1-4,8,11,14H,5-6H2,(H,16,17)(H,18,19)(H,20,21)