4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate

Systemtic Name: 4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate Openeye Name: 4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate CAS Name: 4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate IUPAC Name: 4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate Traditional Name: 4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]benzoate Formula: C9H7N5O2-2 MolecularWeight: 217.18418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NN=N[N-]2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC2=NN=N[N-]2)C(=O)[O-]

InChI

InChI=1S/C9H9N5O2/c15-8(16)7-3-1-6(2-4-7)5-10-9-11-13-14-12-9/h1-4H,5H2,(H3,10,11,12,13,14,15,16)/p-2