2-[4-[(4-bromophenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[(4-bromophenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[(4-bromophenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[(4-bromophenyl)methyl]-1-piperazine-1,4-diiumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[(4-bromophenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-(4-bromobenzyl)piperazine-1,4-diium-1-yl]-1-morpholino-ethanone Formula: C17H26BrN3O2+2 MolecularWeight: 384.31124

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Br)CC(=O)N3CCOCC3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Br)CC(=O)N3CCOCC3

InChI

InChI=1S/C17H24BrN3O2/c18-16-3-1-15(2-4-16)13-19-5-7-20(8-6-19)14-17(22)21-9-11-23-12-10-21/h1-4H,5-14H2/p+2