1-ethyl-4-[(4-methylphenyl)methylsulfonyl]piperazin-1-ium

Systemtic Name: 1-ethyl-4-[(4-methylphenyl)methylsulfonyl]piperazin-1-ium Openeye Name: 1-ethyl-4-(p-tolylmethylsulfonyl)piperazin-1-ium CAS Name: 1-ethyl-4-[(4-methylphenyl)methylsulfonyl]piperazin-1-ium IUPAC Name: 1-ethyl-4-[(4-methylphenyl)methylsulfonyl]piperazin-1-ium Traditional Name: 1-ethyl-4-(4-methylbenzyl)sulfonyl-piperazin-1-ium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C

InChI

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