3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Formula: C12H18N3O3S+ MolecularWeight: 284.35462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3S/c1-14-5-7-15(8-6-14)19(17,18)11-4-2-3-10(9-11)12(13)16/h2-4,9H,5-8H2,1H3,(H2,13,16)/p+1