(2R)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)N)C

InChI

InChI=1S/C15H23N3O3S/c1-11-4-5-14(12(2)10-11)22(20,21)18-8-6-17(7-9-18)13(3)15(16)19/h4-5,10,13H,6-9H2,1-3H3,(H2,16,19)/p+1/t13-/m1/s1