7-azanyl-3H-benzimidazole-5-carboxylate

Systemtic Name: 7-azanyl-3H-benzimidazole-5-carboxylate Openeye Name: 7-amino-3H-benzimidazole-5-carboxylate CAS Name: 7-amino-3H-benzimidazole-5-carboxylate IUPAC Name: 7-amino-3H-benzimidazole-5-carboxylate Traditional Name: 7-amino-3H-benzimidazole-5-carboxylate Formula: C8H6N3O2- MolecularWeight: 176.15214

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC=N2)N)C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=C1NC=N2)N)C(=O)[O-]

InChI

InChI=1S/C8H7N3O2/c9-5-1-4(8(12)13)2-6-7(5)11-3-10-6/h1-3H,9H2,(H,10,11)(H,12,13)/p-1