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

Systemtic Name: 2-[2-azanyl-3-(2-morpholin-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(4-bromophenyl)ethanone Openeye Name: 2-[2-amino-3-(2-morpholinoethyl)benzimidazol-1-ium-1-yl]-1-(4-bromophenyl)ethanone CAS Name: 2-[2-amino-3-[2-(4-morpholinyl)ethyl]-1-benzimidazol-1-iumyl]-1-(4-bromophenyl)ethanone IUPAC Name: 2-[2-amino-3-(2-morpholin-4-ylethyl)benzimidazol-1-ium-1-yl]-1-(4-bromophenyl)ethanone Traditional Name: 2-[2-amino-3-(2-morpholinoethyl)benzimidazol-1-ium-1-yl]-1-(4-bromophenyl)ethanone Formula: C21H24BrN4O2+ MolecularWeight: 444.34486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C3=CC=CC=C3[N+](=C2N)CC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1COCCN1CCN2C3=CC=CC=C3[N+](=C2N)CC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H23BrN4O2/c22-17-7-5-16(6-8-17)20(27)15-26-19-4-2-1-3-18(19)25(21(26)23)10-9-24-11-13-28-14-12-24/h1-8,23H,9-15H2/p+1