1-ethylsulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-ethylsulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium Openeye Name: 1-ethylsulfonyl-4-(p-tolylmethyl)piperazin-4-ium CAS Name: 1-ethylsulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-ethylsulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium Traditional Name: 1-esyl-4-(4-methylbenzyl)piperazin-4-ium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)C

Isomeric SMILES

CCS(=O)(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)C

InChI

InChI=1S/C14H22N2O2S/c1-3-19(17,18)16-10-8-15(9-11-16)12-14-6-4-13(2)5-7-14/h4-7H,3,8-12H2,1-2H3/p+1