1-anthracen-9-yl-3-methyl-benzimidazol-3-ium iodide

Systemtic Name: 1-anthracen-9-yl-3-methyl-benzimidazol-3-ium iodide Openeye Name: 1-(9-anthryl)-3-methyl-benzimidazol-3-ium iodide CAS Name: 1-(9-anthracenyl)-3-methylbenzimidazol-3-ium iodide IUPAC Name: 1-anthracen-9-yl-3-methylbenzimidazol-3-ium iodide Traditional Name: 1-(9-anthryl)-3-methyl-benzimidazol-3-ium iodide Formula: C22H17IN2 MolecularWeight: 436.28825

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)C3=C4C=CC=CC4=CC5=CC=CC=C53.[I-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)C3=C4C=CC=CC4=CC5=CC=CC=C53.[I-]

InChI

InChI=1S/C22H17N2.HI/c1-23-15-24(21-13-7-6-12-20(21)23)22-18-10-4-2-8-16(18)14-17-9-3-5-11-19(17)22;/h2-15H,1H3;1H/q+1;/p-1