2-[[1-[2-(dimethylazaniumyl)ethyl]benzimidazol-2-yl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-[[1-[2-(dimethylazaniumyl)ethyl]benzimidazol-2-yl]iminomethyl]-6-nitro-phenolate Openeye Name: 2-[[1-[2-(dimethylammonio)ethyl]benzimidazol-2-yl]iminomethyl]-6-nitro-phenolate CAS Name: 2-[[1-[2-(dimethylammonio)ethyl]-2-benzimidazolyl]iminomethyl]-6-nitrophenolate IUPAC Name: 2-[[1-[2-(dimethylazaniumyl)ethyl]benzimidazol-2-yl]iminomethyl]-6-nitrophenolate Traditional Name: 2-[[1-[2-(dimethylammonio)ethyl]benzimidazol-2-yl]iminomethyl]-6-nitro-phenolate Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C2=CC=CC=C2N=C1N=CC3=C(C(=CC=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C[NH+](C)CCN1C2=CC=CC=C2N=C1N=CC3=C(C(=CC=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H19N5O3/c1-21(2)10-11-22-15-8-4-3-7-14(15)20-18(22)19-12-13-6-5-9-16(17(13)24)23(25)26/h3-9,12,24H,10-11H2,1-2H3