2-[2-azanyl-3-(2-morpholin-4-ium-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(2,6-dimethoxyphenyl)ethanone

Systemtic Name: 2-[2-azanyl-3-(2-morpholin-4-ium-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(2,6-dimethoxyphenyl)ethanone Openeye Name: 2-[2-amino-3-(2-morpholin-4-ium-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(2,6-dimethoxyphenyl)ethanone CAS Name: 2-[2-amino-3-[2-(4-morpholin-4-iumyl)ethyl]-1-benzimidazol-1-iumyl]-1-(2,6-dimethoxyphenyl)ethanone IUPAC Name: 2-[2-amino-3-(2-morpholin-4-ium-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(2,6-dimethoxyphenyl)ethanone Traditional Name: 2-[2-amino-3-(2-morpholin-4-ium-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(2,6-dimethoxyphenyl)ethanone Formula: C23H30N4O4+2 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)C[N+]2=C(N(C3=CC=CC=C32)CC[NH+]4CCOCC4)N

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)C[N+]2=C(N(C3=CC=CC=C32)CC[NH+]4CCOCC4)N

InChI

InChI=1S/C23H28N4O4/c1-29-20-8-5-9-21(30-2)22(20)19(28)16-27-18-7-4-3-6-17(18)26(23(27)24)11-10-25-12-14-31-15-13-25/h3-9,24H,10-16H2,1-2H3/p+2