2-(4-methylphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium

Systemtic Name: 2-(4-methylphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Openeye Name: 4-(2-piperidin-1-ium-1-ylethyl)-2-(p-tolyl)-3H-imidazo[1,2-a]benzimidazol-4-ium CAS Name: 2-(4-methylphenyl)-4-[2-(1-piperidin-1-iumyl)ethyl]-3H-imidazo[1,2-a]benzimidazol-4-ium IUPAC Name: 2-(4-methylphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Traditional Name: 4-(2-piperidin-1-ium-1-ylethyl)-2-(p-tolyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Formula: C23H28N4+2 MolecularWeight: 360.49522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN3C4=CC=CC=C4[N+](=C3N2)CC[NH+]5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN3C4=CC=CC=C4[N+](=C3N2)CC[NH+]5CCCCC5

InChI

InChI=1S/C23H26N4/c1-18-9-11-19(12-10-18)20-17-27-22-8-4-3-7-21(22)26(23(27)24-20)16-15-25-13-5-2-6-14-25/h3-4,7-12,17H,2,5-6,13-16H2,1H3/p+2