1-[4-(3-bromanylphenoxy)butyl]piperazine-1,4-diium

Systemtic Name: 1-[4-(3-bromanylphenoxy)butyl]piperazine-1,4-diium Openeye Name: 1-[4-(3-bromophenoxy)butyl]piperazine-1,4-diium CAS Name: 1-[4-(3-bromophenoxy)butyl]piperazine-1,4-diium IUPAC Name: 1-[4-(3-bromophenoxy)butyl]piperazine-1,4-diium Traditional Name: 1-[4-(3-bromophenoxy)butyl]piperazine-1,4-diium Formula: C14H23BrN2O+2 MolecularWeight: 315.24922

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCCCOC2=CC(=CC=C2)Br

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H21BrN2O/c15-13-4-3-5-14(12-13)18-11-2-1-8-17-9-6-16-7-10-17/h3-5,12,16H,1-2,6-11H2/p+2