1,4-bis(2-ethoxyethyl)-1,4-bis(2-phenylmethoxyethyl)piperazine-1,4-diium dibromide

Systemtic Name: 1,4-bis(2-ethoxyethyl)-1,4-bis(2-phenylmethoxyethyl)piperazine-1,4-diium dibromide Openeye Name: 1,4-bis(2-benzyloxyethyl)-1,4-bis(2-ethoxyethyl)piperazine-1,4-diium dibromide CAS Name: 1,4-bis(2-ethoxyethyl)-1,4-bis(2-phenylmethoxyethyl)piperazine-1,4-diium dibromide IUPAC Name: 1,4-bis(2-ethoxyethyl)-1,4-bis(2-phenylmethoxyethyl)piperazine-1,4-diium dibromide Traditional Name: 1,4-bis(2-benzoxyethyl)-1,4-bis(2-ethoxyethyl)piperazine-1,4-diium dibromide Formula: C30H48Br2N2O4 MolecularWeight: 660.52112

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC[N+]1(CC[N+](CC1)(CCOCC)CCOCC2=CC=CC=C2)CCOCC3=CC=CC=C3.[Br-].[Br-]

Isomeric SMILES

CCOCC[N+]1(CC[N+](CC1)(CCOCC)CCOCC2=CC=CC=C2)CCOCC3=CC=CC=C3.[Br-].[Br-]

InChI

InChI=1S/C30H48N2O4.2BrH/c1-3-33-23-19-31(21-25-35-27-29-11-7-5-8-12-29)15-17-32(18-16-31,20-24-34-4-2)22-26-36-28-30-13-9-6-10-14-30;;/h5-14H,3-4,15-28H2,1-2H3;2*1H/q+2;;/p-2