[1-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-piperidin-4-yl-methanone

Systemtic Name: [1-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-piperidin-4-yl-methanone Openeye Name: [1-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-(4-piperidyl)methanone CAS Name: [1-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-(4-piperidinyl)methanone IUPAC Name: [1-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-piperidin-4-ylmethanone Traditional Name: (1-brosylpiperazin-1-ium-1-yl)-(4-piperidyl)methanone Formula: C16H23BrN3O3S+ MolecularWeight: 417.34112

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)[N+]2(CCNCC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CNCCC1C(=O)[N+]2(CCNCC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H23BrN3O3S/c17-14-1-3-15(4-2-14)24(22,23)20(11-9-19-10-12-20)16(21)13-5-7-18-8-6-13/h1-4,13,18-19H,5-12H2/q+1