(2R)-1-[2-(4-bromanylphenoxy)ethoxy]-3-(4-ethylpiperazine-1,4-diium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-[2-(4-bromanylphenoxy)ethoxy]-3-(4-ethylpiperazine-1,4-diium-1-yl)propan-2-ol Openeye Name: (2R)-1-[2-(4-bromophenoxy)ethoxy]-3-(4-ethylpiperazine-1,4-diium-1-yl)propan-2-ol CAS Name: (2R)-1-[2-(4-bromophenoxy)ethoxy]-3-(4-ethyl-1-piperazine-1,4-diiumyl)-2-propanol IUPAC Name: (2R)-1-[2-(4-bromophenoxy)ethoxy]-3-(4-ethylpiperazine-1,4-diium-1-yl)propan-2-ol Traditional Name: (2R)-1-[2-(4-bromophenoxy)ethoxy]-3-(4-ethylpiperazine-1,4-diium-1-yl)propan-2-ol Formula: C17H29BrN2O3+2 MolecularWeight: 389.32776

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(COCCOC2=CC=C(C=C2)Br)O

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)C[C@H](COCCOC2=CC=C(C=C2)Br)O

InChI

InChI=1S/C17H27BrN2O3/c1-2-19-7-9-20(10-8-19)13-16(21)14-22-11-12-23-17-5-3-15(18)4-6-17/h3-6,16,21H,2,7-14H2,1H3/p+2/t16-/m1/s1