2-(azocan-1-ium-1-yl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[4-[butyl(methyl)sulfamoyl]phenyl]acetamide Formula: C20H34N3O3S+ MolecularWeight: 396.56726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCCCCCC2

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCCCCCC2

InChI

InChI=1S/C20H33N3O3S/c1-3-4-14-22(2)27(25,26)19-12-10-18(11-13-19)21-20(24)17-23-15-8-6-5-7-9-16-23/h10-13H,3-9,14-17H2,1-2H3,(H,21,24)/p+1