2-(3-bromanylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3-bromanylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(3-bromophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(3-bromophenoxy)-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(3-bromophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(3-bromophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C20H25BrN3O2+ MolecularWeight: 419.3354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H24BrN3O2/c1-2-23-10-12-24(13-11-23)19-9-4-3-8-18(19)22-20(25)15-26-17-7-5-6-16(21)14-17/h3-9,14H,2,10-13,15H2,1H3,(H,22,25)/p+1