(2R)-2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(3-bromophenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C13H19BrN3O3S+ MolecularWeight: 377.27726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)N)[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C13H18BrN3O3S/c1-10(13(15)18)16-5-7-17(8-6-16)21(19,20)12-4-2-3-11(14)9-12/h2-4,9-10H,5-8H2,1H3,(H2,15,18)/p+1/t10-/m1/s1