2-(2-bromanyl-4-propan-2-yl-phenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(2-bromanyl-4-propan-2-yl-phenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(2-bromo-4-isopropyl-phenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(2-bromo-4-propan-2-ylphenoxy)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(2-bromo-4-propan-2-ylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(2-bromo-4-isopropyl-phenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C16H24BrN2O2+ MolecularWeight: 356.27796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCC(=O)N2CC[NH+](CC2)C)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCC(=O)N2CC[NH+](CC2)C)Br

InChI

InChI=1S/C16H23BrN2O2/c1-12(2)13-4-5-15(14(17)10-13)21-11-16(20)19-8-6-18(3)7-9-19/h4-5,10,12H,6-9,11H2,1-3H3/p+1