N-(3-chlorophenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]methanesulfonamide

Systemtic Name: N-(3-chlorophenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]methanesulfonamide Openeye Name: N-(3-chlorophenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxo-butyl]methanesulfonamide CAS Name: N-(3-chlorophenyl)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-4-oxobutyl]methanesulfonamide IUPAC Name: N-(3-chlorophenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxobutyl]methanesulfonamide Traditional Name: N-(3-chlorophenyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-4-keto-butyl]methanesulfonamide Formula: C17H27ClN3O3S+ MolecularWeight: 388.93258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26ClN3O3S/c1-3-19-10-12-20(13-11-19)17(22)8-5-9-21(25(2,23)24)16-7-4-6-15(18)14-16/h4,6-7,14H,3,5,8-13H2,1-2H3/p+1