azanium 2-aminocarbonyl-3-nitro-benzoate

Systemtic Name: azanium 2-aminocarbonyl-3-nitro-benzoate Openeye Name: ammonium 2-carbamoyl-3-nitro-benzoate CAS Name: ammonium 2-carbamoyl-3-nitrobenzoate IUPAC Name: azanium 2-carbamoyl-3-nitrobenzoate Traditional Name: ammonium 2-carbamoyl-3-nitro-benzoate Formula: C8H9N3O5 MolecularWeight: 227.17416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)N)C(=O)[O-].[NH4+]

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)N)C(=O)[O-].[NH4+]

InChI

InChI=1S/C8H6N2O5.H3N/c9-7(11)6-4(8(12)13)2-1-3-5(6)10(14)15;/h1-3H,(H2,9,11)(H,12,13);1H3