N-(2-bromophenyl)-4-propyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-propyl-piperazin-4-ium-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-propyl-piperazin-4-ium-1-carboxamide CAS Name: N-(2-bromophenyl)-4-propyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-bromophenyl)-4-propylpiperazin-4-ium-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-propyl-piperazin-4-ium-1-carboxamide Formula: C14H21BrN3O+ MolecularWeight: 327.24004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C14H20BrN3O/c1-2-7-17-8-10-18(11-9-17)14(19)16-13-6-4-3-5-12(13)15/h3-6H,2,7-11H2,1H3,(H,16,19)/p+1