(5-bromanylpyridin-3-yl)-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-(4-methylquinolin-1-ium-2-yl)piperazino]methanone Formula: C20H20BrN4O+ MolecularWeight: 412.303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C20H19BrN4O/c1-14-10-19(23-18-5-3-2-4-17(14)18)24-6-8-25(9-7-24)20(26)15-11-16(21)13-22-12-15/h2-5,10-13H,6-9H2,1H3/p+1