2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(5-nitro-1-benzofuran-2-yl)ethanone hydrobromide

Systemtic Name: 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(5-nitro-1-benzofuran-2-yl)ethanone hydrobromide Openeye Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(5-nitrobenzofuran-2-yl)ethanone hydrobromide CAS Name: 2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]-1-(5-nitro-2-benzofuranyl)ethanone hydrobromide IUPAC Name: 2-(3-benzyl-2-iminobenzimidazol-1-yl)-1-(5-nitro-1-benzofuran-2-yl)ethanone hydrobromide Traditional Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(5-nitrobenzofuran-2-yl)ethanone hydrobromide Formula: C24H19BrN4O4 MolecularWeight: 507.33606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC5=C(O4)C=CC(=C5)[N+](=O)[O-].Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC5=C(O4)C=CC(=C5)[N+](=O)[O-].Br

InChI

InChI=1S/C24H18N4O4.BrH/c25-24-26(14-16-6-2-1-3-7-16)19-8-4-5-9-20(19)27(24)15-21(29)23-13-17-12-18(28(30)31)10-11-22(17)32-23;/h1-13,25H,14-15H2;1H