3-(3,5-dinitro-2-oxidanyl-phenyl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(3,5-dinitro-2-oxidanyl-phenyl)-2-oxidanyl-propanoic acid Openeye Name: 2-hydroxy-3-(2-hydroxy-3,5-dinitro-phenyl)propanoic acid CAS Name: 2-hydroxy-3-(2-hydroxy-3,5-dinitrophenyl)propanoic acid IUPAC Name: 2-hydroxy-3-(2-hydroxy-3,5-dinitrophenyl)propanoic acid Traditional Name: 2-hydroxy-3-(2-hydroxy-3,5-dinitro-phenyl)propionic acid Formula: C9H8N2O8 MolecularWeight: 272.16842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O8/c12-7(9(14)15)2-4-1-5(10(16)17)3-6(8(4)13)11(18)19/h1,3,7,12-13H,2H2,(H,14,15)