(2R)-2-(4-bromanylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: (2R)-2-(4-bromanylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: (2R)-2-(4-bromophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one CAS Name: (2R)-2-(4-bromophenoxy)-1-(4-methyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2R)-2-(4-bromophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: (2R)-2-(4-bromophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Formula: C14H20BrN2O2+ MolecularWeight: 328.2248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)C)OC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)C)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H19BrN2O2/c1-11(19-13-5-3-12(15)4-6-13)14(18)17-9-7-16(2)8-10-17/h3-6,11H,7-10H2,1-2H3/p+1/t11-/m1/s1