N,N-dimethyl-4-[(1S)-1-piperazin-4-ium-1-ylethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[(1S)-1-piperazin-4-ium-1-ylethyl]benzenesulfonamide Openeye Name: N,N-dimethyl-4-[(1S)-1-piperazin-4-ium-1-ylethyl]benzenesulfonamide CAS Name: N,N-dimethyl-4-[(1S)-1-(1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-4-[(1S)-1-piperazin-4-ium-1-ylethyl]benzenesulfonamide Traditional Name: N,N-dimethyl-4-[(1S)-1-piperazin-4-ium-1-ylethyl]benzenesulfonamide Formula: C14H24N3O2S+ MolecularWeight: 298.42426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N(C)C)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N(C)C)N2CC[NH2+]CC2

InChI

InChI=1S/C14H23N3O2S/c1-12(17-10-8-15-9-11-17)13-4-6-14(7-5-13)20(18,19)16(2)3/h4-7,12,15H,8-11H2,1-3H3/p+1/t12-/m0/s1