2-(1H-benzimidazol-2-yl)-4-nitro-phenolate

Systemtic Name: 2-(1H-benzimidazol-2-yl)-4-nitro-phenolate Openeye Name: 2-(1H-benzimidazol-2-yl)-4-nitro-phenolate CAS Name: 2-(1H-benzimidazol-2-yl)-4-nitrophenolate IUPAC Name: 2-(1H-benzimidazol-2-yl)-4-nitrophenolate Traditional Name: 2-(1H-benzimidazol-2-yl)-4-nitro-phenolate Formula: C13H8N3O3- MolecularWeight: 254.22092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C13H9N3O3/c17-12-6-5-8(16(18)19)7-9(12)13-14-10-3-1-2-4-11(10)15-13/h1-7,17H,(H,14,15)/p-1