1-(phenylmethyl)-3-[[3-(phenylmethyl)imidazol-1-ium-1-yl]methyl]imidazol-3-ium

Systemtic Name: 1-(phenylmethyl)-3-[[3-(phenylmethyl)imidazol-1-ium-1-yl]methyl]imidazol-3-ium Openeye Name: 1-benzyl-3-[(3-benzylimidazol-1-ium-1-yl)methyl]imidazol-3-ium CAS Name: 1-(phenylmethyl)-3-[[3-(phenylmethyl)-1-imidazol-1-iumyl]methyl]imidazol-3-ium IUPAC Name: 1-benzyl-3-[(3-benzylimidazol-1-ium-1-yl)methyl]imidazol-3-ium Traditional Name: 1-benzyl-3-[(3-benzylimidazol-1-ium-1-yl)methyl]imidazol-3-ium Formula: C21H22N4+2 MolecularWeight: 330.42618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C[N+](=C2)C[N+]3=CN(C=C3)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C[N+](=C2)C[N+]3=CN(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4/c1-3-7-20(8-4-1)15-22-11-13-24(17-22)19-25-14-12-23(18-25)16-21-9-5-2-6-10-21/h1-14,17-18H,15-16,19H2/q+2