(3-methylimidazol-3-ium-1-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methylimidazol-3-ium-1-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methylimidazol-3-ium-1-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3-methyl-1-imidazol-3-iumyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methylimidazol-3-ium-1-yl)methanone Traditional Name: (4-besylpiperazino)-(3-methylimidazol-3-ium-1-yl)methanone Formula: C15H19N4O3S+ MolecularWeight: 335.40136

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[N+]1=CN(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H19N4O3S/c1-16-7-8-18(13-16)15(20)17-9-11-19(12-10-17)23(21,22)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3/q+1