3-ethanoyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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