N-(2-fluorophenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(2-fluorophenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(2-fluorophenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(2-fluorophenyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(2-fluorophenyl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(2-fluorophenyl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C13H19FN3O3S+ MolecularWeight: 316.371663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C13H18FN3O3S/c14-11-3-1-2-4-12(11)16-13(18)5-10-21(19,20)17-8-6-15-7-9-17/h1-4,15H,5-10H2,(H,16,18)/p+1