2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(2,5-dibromophenyl)sulfonyl-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Formula: C12H17Br2N2O3S+ MolecularWeight: 429.14798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

Isomeric SMILES

C1CN(CC[NH+]1CCO)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

InChI

InChI=1S/C12H16Br2N2O3S/c13-10-1-2-11(14)12(9-10)20(18,19)16-5-3-15(4-6-16)7-8-17/h1-2,9,17H,3-8H2/p+1