N-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-ethyl-N-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]-4-methylbenzenesulfonamide IUPAC Name: N-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]-4-methylbenzenesulfonamide Traditional Name: N-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]-4-methyl-benzenesulfonamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3S/c1-4-18-10-12-19(13-11-18)17(21)14-20(5-2)24(22,23)16-8-6-15(3)7-9-16/h6-9H,4-5,10-14H2,1-3H3/p+1