4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid

Systemtic Name: 4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid Openeye Name: 4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid CAS Name: 4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid IUPAC Name: 4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid Traditional Name: 4-azabicyclo[3.1.1]hepta-2,5-diene-2,3,6-tricarboxylic acid Formula: C9H7NO6 MolecularWeight: 225.15498

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(=C1NC(=C2C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1C2C(=C1NC(=C2C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C9H7NO6/c11-7(12)4-2-1-3(4)10-6(9(15)16)5(2)8(13)14/h2,10H,1H2,(H,11,12)(H,13,14)(H,15,16)