2,3-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline

Systemtic Name: 2,3-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline Openeye Name: 2,3-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline CAS Name: 2,3-dimethyl-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 2,3-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [2,3-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]amine Formula: C13H22N3O2S+ MolecularWeight: 284.39768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)N)S(=O)(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=CC(=C1C)N)S(=O)(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C13H21N3O2S/c1-10-8-12(9-13(14)11(10)2)19(17,18)16-6-4-15(3)5-7-16/h8-9H,4-7,14H2,1-3H3/p+1