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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-nitro-1-oxidanyl-benzimidazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-hydroxy-6-nitro-benzimidazole CAS Name: 2-(1,3-benzodioxol-5-yl)-1-hydroxy-6-nitrobenzimidazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-hydroxy-6-nitrobenzimidazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-hydroxy-6-nitro-benzimidazole Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5/c18-16-11-6-9(17(19)20)2-3-10(11)15-14(16)8-1-4-12-13(5-8)22-7-21-12/h1-6,18H,7H2