2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole

Systemtic Name: 2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole Openeye Name: 2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole CAS Name: 2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole IUPAC Name: 2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole Traditional Name: 2-(6-nitro-1,3-benzodioxol-5-yl)-1H-benzimidazole Formula: C14H9N3O4 MolecularWeight: 283.23896

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O4/c18-17(19)11-6-13-12(20-7-21-13)5-8(11)14-15-9-3-1-2-4-10(9)16-14/h1-6H,7H2,(H,15,16)