2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitro-phenolate Openeye Name: 2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitro-phenolate CAS Name: 2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitrophenolate IUPAC Name: 2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitrophenolate Traditional Name: 2-[[2-(2,4-dichlorophenyl)-3H-benzimidazol-5-yl]iminomethyl]-4,6-dinitro-phenolate Formula: C20H10Cl2N5O5- MolecularWeight: 471.2299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-])NC(=N2)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-])NC(=N2)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H11Cl2N5O5/c21-11-1-3-14(15(22)6-11)20-24-16-4-2-12(7-17(16)25-20)23-9-10-5-13(26(29)30)8-18(19(10)28)27(31)32/h1-9,28H,(H,24,25)/p-1