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

Systemtic Name: 3-chloranyl-4-ethoxy-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-methyl-benzenesulfonamide Openeye Name: 3-chloro-4-ethoxy-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-methyl-benzenesulfonamide CAS Name: 3-chloro-4-ethoxy-N-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-methylbenzenesulfonamide IUPAC Name: 3-chloro-4-ethoxy-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-methylbenzenesulfonamide Traditional Name: 3-chloro-4-ethoxy-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-methyl-benzenesulfonamide Formula: C17H27ClN3O4S+ MolecularWeight: 404.93198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26ClN3O4S/c1-4-20-8-10-21(11-9-20)17(22)13-19(3)26(23,24)14-6-7-16(25-5-2)15(18)12-14/h6-7,12H,4-5,8-11,13H2,1-3H3/p+1