N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methoxy-5-methyl-benzenesulfonamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methoxy-5-methyl-benzenesulfonamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methoxy-5-methyl-benzenesulfonamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-methoxy-5-methylbenzenesulfonamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methoxy-5-methylbenzenesulfonamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methoxy-5-methyl-benzenesulfonamide Formula: C20H27ClN3O3S+ MolecularWeight: 424.96468

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C20H26ClN3O3S/c1-4-23-9-11-24(12-10-23)18-7-6-16(21)14-17(18)22-28(25,26)20-13-15(2)5-8-19(20)27-3/h5-8,13-14,22H,4,9-12H2,1-3H3/p+1