1-(2-bromophenyl)sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-(2-bromophenyl)sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-(2-bromophenyl)sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-(2-bromophenyl)sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-(2-bromophenyl)sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-(2-bromophenyl)sulfonyl-4-ethyl-piperazin-4-ium Formula: C12H18BrN2O2S+ MolecularWeight: 334.25252

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C12H17BrN2O2S/c1-2-14-7-9-15(10-8-14)18(16,17)12-6-4-3-5-11(12)13/h3-6H,2,7-10H2,1H3/p+1