2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-yl-ethanamide Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopropyl-N-methyl-acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-methyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-ylacetamide Traditional Name: 2-(4-brosylpiperazin-1-ium-1-yl)-N-isopropyl-N-methyl-acetamide Formula: C16H25BrN3O3S+ MolecularWeight: 419.357

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24BrN3O3S/c1-13(2)18(3)16(21)12-19-8-10-20(11-9-19)24(22,23)15-6-4-14(17)5-7-15/h4-7,13H,8-12H2,1-3H3/p+1