7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidopentanedioic acid

Systemtic Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidopentanedioic acid Openeye Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidopentanedioic acid CAS Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidopentanedioic acid IUPAC Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidopentanedioic acid Traditional Name: 7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-nitramidoglutaric acid Formula: C11H13N3O6 MolecularWeight: 283.23742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC=C1N2.C(CC(=O)O)C(C(=O)O)N[N+](=O)[O-]

Isomeric SMILES

C1=CC2=CC=C1N2.C(CC(=O)O)C(C(=O)O)N[N+](=O)[O-]

InChI

InChI=1S/C6H5N.C5H8N2O6/c1-2-6-4-3-5(1)7-6;8-4(9)2-1-3(5(10)11)6-7(12)13/h1-4,7H;3,6H,1-2H2,(H,8,9)(H,10,11)