N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(3-bromophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H26BrN3O2+2 MolecularWeight: 420.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H24BrN3O2/c21-17-5-4-6-18(15-17)22-20(25)16-24-11-9-23(10-12-24)13-14-26-19-7-2-1-3-8-19/h1-8,15H,9-14,16H2,(H,22,25)/p+2