2-(4,5-dimethoxy-2-nitro-phenyl)-1H-benzimidazole

Systemtic Name: 2-(4,5-dimethoxy-2-nitro-phenyl)-1H-benzimidazole Openeye Name: 2-(4,5-dimethoxy-2-nitro-phenyl)-1H-benzimidazole CAS Name: 2-(4,5-dimethoxy-2-nitrophenyl)-1H-benzimidazole IUPAC Name: 2-(4,5-dimethoxy-2-nitrophenyl)-1H-benzimidazole Traditional Name: 2-(4,5-dimethoxy-2-nitro-phenyl)-1H-benzimidazole Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3N2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13N3O4/c1-21-13-7-9(12(18(19)20)8-14(13)22-2)15-16-10-5-3-4-6-11(10)17-15/h3-8H,1-2H3,(H,16,17)