N,N-diethyl-4-[2-(1-methyl-3-phenyl-benzimidazol-1-ium-2-yl)ethenyl]aniline chloride

Systemtic Name: N,N-diethyl-4-[2-(1-methyl-3-phenyl-benzimidazol-1-ium-2-yl)ethenyl]aniline chloride Openeye Name: N,N-diethyl-4-[2-(1-methyl-3-phenyl-benzimidazol-1-ium-2-yl)vinyl]aniline chloride CAS Name: N,N-diethyl-4-[2-(1-methyl-3-phenyl-2-benzimidazol-1-iumyl)ethenyl]aniline chloride IUPAC Name: N,N-diethyl-4-[2-(1-methyl-3-phenylbenzimidazol-1-ium-2-yl)ethenyl]aniline chloride Traditional Name: diethyl-[4-[2-(1-methyl-3-phenyl-benzimidazol-1-ium-2-yl)vinyl]phenyl]amine chloride Formula: C26H28ClN3 MolecularWeight: 417.97362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=CC2=[N+](C3=CC=CC=C3N2C4=CC=CC=C4)C.[Cl-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C=CC2=[N+](C3=CC=CC=C3N2C4=CC=CC=C4)C.[Cl-]

InChI

InChI=1S/C26H28N3.ClH/c1-4-28(5-2)22-18-15-21(16-19-22)17-20-26-27(3)24-13-9-10-14-25(24)29(26)23-11-7-6-8-12-23;/h6-20H,4-5H2,1-3H3;1H/q+1;/p-1