2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-ethyl-ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-ethyl-ethanamide Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-ethyl-acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-cyclohexyl-N-ethylacetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-ethylacetamide Traditional Name: 2-(4-brosylpiperazin-1-ium-1-yl)-N-cyclohexyl-N-ethyl-acetamide Formula: C20H31BrN3O3S+ MolecularWeight: 473.44744

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H30BrN3O3S/c1-2-24(18-6-4-3-5-7-18)20(25)16-22-12-14-23(15-13-22)28(26,27)19-10-8-17(21)9-11-19/h8-11,18H,2-7,12-16H2,1H3/p+1