(2R)-1-[2-(2-bromanylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-[2-(2-bromanylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-[2-(2-bromophenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-[2-(2-bromophenoxy)ethoxy]-3-(4-ethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-(2-bromophenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-[2-(2-bromophenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C17H28BrN2O3+ MolecularWeight: 388.31982

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COCCOC2=CC=CC=C2Br)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@H](COCCOC2=CC=CC=C2Br)O

InChI

InChI=1S/C17H27BrN2O3/c1-2-19-7-9-20(10-8-19)13-15(21)14-22-11-12-23-17-6-4-3-5-16(17)18/h3-6,15,21H,2,7-14H2,1H3/p+1/t15-/m1/s1