2-[(E)-2-(4-nitrophenyl)ethenyl]-1H-benzimidazol-1-ium chloride

Systemtic Name: 2-[(E)-2-(4-nitrophenyl)ethenyl]-1H-benzimidazol-1-ium chloride Openeye Name: 2-[(E)-2-(4-nitrophenyl)vinyl]-1H-benzimidazol-1-ium chloride CAS Name: 2-[(E)-2-(4-nitrophenyl)ethenyl]-1H-benzimidazol-1-ium chloride IUPAC Name: 2-[(E)-2-(4-nitrophenyl)ethenyl]-1H-benzimidazol-1-ium chloride Traditional Name: 2-[(E)-2-(4-nitrophenyl)vinyl]-1H-benzimidazol-1-ium chloride Formula: C15H12ClN3O2 MolecularWeight: 301.72768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH2+]C(=N2)C=CC3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)[NH2+]C(=N2)/C=C/C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C15H11N3O2.ClH/c19-18(20)12-8-5-11(6-9-12)7-10-15-16-13-3-1-2-4-14(13)17-15;/h1-10H,(H,16,17);1H/b10-7+;