3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl-propan-2-yl-azanium

Systemtic Name: 3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl-propan-2-yl-azanium Openeye Name: isopropyl-[3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]ammonium CAS Name: 3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl-propan-2-ylammonium IUPAC Name: 3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl-propan-2-ylazanium Traditional Name: isopropyl-[3-[2-(4-methoxyphenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]ammonium Formula: C22H28N4O+2 MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CCCN1C(=C[N+]2=C1NC3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)[NH2+]CCCN1C(=C[N+]2=C1NC3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H26N4O/c1-16(2)23-13-6-14-25-21(17-9-11-18(27-3)12-10-17)15-26-20-8-5-4-7-19(20)24-22(25)26/h4-5,7-12,15-16,23H,6,13-14H2,1-3H3/p+2