N-[(3,4-dichlorophenyl)methyl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]methanesulfonamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-N-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]methanesulfonamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]methanesulfonamide Traditional Name: N-(3,4-dichlorobenzyl)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]methanesulfonamide Formula: C16H24Cl2N3O3S+ MolecularWeight: 409.35106

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CN(CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CN(CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C16H23Cl2N3O3S/c1-3-19-6-8-20(9-7-19)16(22)12-21(25(2,23)24)11-13-4-5-14(17)15(18)10-13/h4-5,10H,3,6-9,11-12H2,1-2H3/p+1