diazanium benzene-1,3-dicarboxylate

Systemtic Name: diazanium benzene-1,3-dicarboxylate Openeye Name: diammonium benzene-1,3-dicarboxylate CAS Name: diammonium benzene-1,3-dicarboxylate IUPAC Name: diazanium benzene-1,3-dicarboxylate Traditional Name: diammonium isophthalate Formula: C8H12N2O4 MolecularWeight: 200.19188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6O4.2H3N/c9-7(10)5-2-1-3-6(4-5)8(11)12;;/h1-4H,(H,9,10)(H,11,12);2*1H3