2-chloranyl-N,N-diethyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N,N-diethyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-benzenesulfonamide Openeye Name: 2-chloro-N,N-diethyl-5-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide CAS Name: 2-chloro-N,N-diethyl-5-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]benzenesulfonamide IUPAC Name: 2-chloro-N,N-diethyl-5-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide Traditional Name: 2-chloro-N,N-diethyl-5-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide Formula: C16H25ClN3O3S+ MolecularWeight: 374.906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C16H24ClN3O3S/c1-4-20(5-2)24(22,23)15-12-13(6-7-14(15)17)16(21)19-10-8-18(3)9-11-19/h6-7,12H,4-5,8-11H2,1-3H3/p+1