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

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]piperazine-1,4-diium CAS Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]piperazine-1,4-diium Formula: C12H18BrClN2O+2 MolecularWeight: 321.64112

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCOC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCOC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C12H16BrClN2O/c13-10-1-2-12(11(14)9-10)17-8-7-16-5-3-15-4-6-16/h1-2,9,15H,3-8H2/p+2