(6-nitro-1H-benzimidazol-2-yl)methyl pyrazine-2-carboxylate

Systemtic Name: (6-nitro-1H-benzimidazol-2-yl)methyl pyrazine-2-carboxylate Openeye Name: (6-nitro-1H-benzimidazol-2-yl)methyl pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid (6-nitro-1H-benzimidazol-2-yl)methyl ester IUPAC Name: (6-nitro-1H-benzimidazol-2-yl)methyl pyrazine-2-carboxylate Traditional Name: pyrazinic acid (6-nitro-1H-benzimidazol-2-yl)methyl ester Formula: C13H9N5O4 MolecularWeight: 299.24166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)COC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)COC(=O)C3=NC=CN=C3

InChI

InChI=1S/C13H9N5O4/c19-13(11-6-14-3-4-15-11)22-7-12-16-9-2-1-8(18(20)21)5-10(9)17-12/h1-6H,7H2,(H,16,17)