2-[2-azanyl-3-(2-morpholin-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(4-methylphenyl)ethanone

Systemtic Name: 2-[2-azanyl-3-(2-morpholin-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(4-methylphenyl)ethanone Openeye Name: 2-[2-amino-3-(2-morpholinoethyl)benzimidazol-1-ium-1-yl]-1-(p-tolyl)ethanone CAS Name: 2-[2-amino-3-[2-(4-morpholinyl)ethyl]-1-benzimidazol-1-iumyl]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[2-amino-3-(2-morpholin-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(4-methylphenyl)ethanone Traditional Name: 2-[2-amino-3-(2-morpholinoethyl)benzimidazol-1-ium-1-yl]-1-(p-tolyl)ethanone Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=C(N(C3=CC=CC=C32)CCN4CCOCC4)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=C(N(C3=CC=CC=C32)CCN4CCOCC4)N

InChI

InChI=1S/C22H26N4O2/c1-17-6-8-18(9-7-17)21(27)16-26-20-5-3-2-4-19(20)25(22(26)23)11-10-24-12-14-28-15-13-24/h2-9,23H,10-16H2,1H3/p+1