1-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]piperazine-1,4-diium

Systemtic Name: 1-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-[3-(2-bromo-4-chloro-phenoxy)propyl]piperazine-1,4-diium CAS Name: 1-[3-(2-bromo-4-chlorophenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-[3-(2-bromo-4-chlorophenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-[3-(2-bromo-4-chloro-phenoxy)propyl]piperazine-1,4-diium Formula: C13H20BrClN2O+2 MolecularWeight: 335.6677

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCCOC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCCOC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C13H18BrClN2O/c14-12-10-11(15)2-3-13(12)18-9-1-6-17-7-4-16-5-8-17/h2-3,10,16H,1,4-9H2/p+2