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

Systemtic Name: (2R)-2-(2-bromanylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-(2-bromophenoxy)propan-1-one CAS Name: (2R)-2-(2-bromophenoxy)-1-(4-prop-2-enyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2R)-2-(2-bromophenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-(2-bromophenoxy)propan-1-one Formula: C16H22BrN2O2+ MolecularWeight: 354.26208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)CC=C)OC2=CC=CC=C2Br

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)CC=C)OC2=CC=CC=C2Br

InChI

InChI=1S/C16H21BrN2O2/c1-3-8-18-9-11-19(12-10-18)16(20)13(2)21-15-7-5-4-6-14(15)17/h3-7,13H,1,8-12H2,2H3/p+1/t13-/m1/s1