3-bromanyl-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 3-bromanyl-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 3-bromo-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 3-bromo-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 3-bromo-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 3-bromo-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C12H17BrN3O+ MolecularWeight: 299.18688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H16BrN3O/c1-15-5-7-16(8-6-15)14-12(17)10-3-2-4-11(13)9-10/h2-4,9H,5-8H2,1H3,(H,14,17)/p+1