2-(1-methyl-4-nitro-pyrrol-2-yl)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(1-methyl-4-nitro-pyrrol-2-yl)-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-(1-methyl-4-nitro-pyrrol-2-yl)-3H-benzimidazole-5-carboxylic acid CAS Name: 2-(1-methyl-4-nitro-2-pyrrolyl)-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-(1-methyl-4-nitropyrrol-2-yl)-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-(1-methyl-4-nitro-pyrrol-2-yl)-3H-benzimidazole-5-carboxylic acid Formula: C13H10N4O4 MolecularWeight: 286.2429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O4/c1-16-6-8(17(20)21)5-11(16)12-14-9-3-2-7(13(18)19)4-10(9)15-12/h2-6H,1H3,(H,14,15)(H,18,19)