azanium 4-[[2-oxidanylidene-2-(pyridin-4-ylamino)ethanoyl]amino]benzoate

Systemtic Name: azanium 4-[[2-oxidanylidene-2-(pyridin-4-ylamino)ethanoyl]amino]benzoate Openeye Name: ammonium 4-[[2-oxo-2-(4-pyridylamino)acetyl]amino]benzoate CAS Name: ammonium 4-[[1,2-dioxo-2-(pyridin-4-ylamino)ethyl]amino]benzoate IUPAC Name: azanium 4-[[2-oxo-2-(pyridin-4-ylamino)acetyl]amino]benzoate Traditional Name: ammonium 4-[[2-keto-2-(4-pyridylamino)acetyl]amino]benzoate Formula: C14H14N4O4 MolecularWeight: 302.28536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC(=O)C(=O)NC2=CC=NC=C2.[NH4+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC(=O)C(=O)NC2=CC=NC=C2.[NH4+]

InChI

InChI=1S/C14H11N3O4.H3N/c18-12(13(19)17-11-5-7-15-8-6-11)16-10-3-1-9(2-4-10)14(20)21;/h1-8H,(H,16,18)(H,20,21)(H,15,17,19);1H3