(5-bromanylfuran-2-yl)-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-bromanylfuran-2-yl)-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-bromo-2-furyl)-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: (5-bromo-2-furanyl)-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromofuran-2-yl)-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-bromo-2-furyl)-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C12H18BrN2O2+ MolecularWeight: 302.18752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C12H17BrN2O2/c1-2-5-14-6-8-15(9-7-14)12(16)10-3-4-11(13)17-10/h3-4H,2,5-9H2,1H3/p+1