N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(3-bromophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propionamide Formula: C15H23BrN3O2+ MolecularWeight: 357.26602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)Br)CCO

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)Br)CCO

InChI

InChI=1S/C15H22BrN3O2/c16-13-2-1-3-14(12-13)17-15(21)4-5-18-6-8-19(9-7-18)10-11-20/h1-3,12,20H,4-11H2,(H,17,21)/p+1