3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-N-methyl-N-phenyl-benzenesulfonamide

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-N-methyl-N-phenyl-benzenesulfonamide Openeye Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-N-methyl-N-phenyl-benzenesulfonamide CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-N-methyl-N-phenylbenzenesulfonamide IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-N-methyl-N-phenylbenzenesulfonamide Traditional Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-N-methyl-N-phenyl-benzenesulfonamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3S/c1-3-22-12-14-23(15-13-22)20(24)17-8-7-11-19(16-17)27(25,26)21(2)18-9-5-4-6-10-18/h4-11,16H,3,12-15H2,1-2H3/p+1