2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide

Systemtic Name: 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone hydrobromide Openeye Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-nitrophenyl)ethanone hydrobromide CAS Name: 2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]-1-(4-nitrophenyl)ethanone hydrobromide IUPAC Name: 2-(3-benzyl-2-iminobenzimidazol-1-yl)-1-(4-nitrophenyl)ethanone hydrobromide Traditional Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-nitrophenyl)ethanone hydrobromide Formula: C22H19BrN4O3 MolecularWeight: 467.31526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O3.BrH/c23-22-24(14-16-6-2-1-3-7-16)19-8-4-5-9-20(19)25(22)15-21(27)17-10-12-18(13-11-17)26(28)29;/h1-13,23H,14-15H2;1H