2-(azocan-1-ium-1-yl)-N-[4-chloranyl-3-(diethylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[4-chloranyl-3-(diethylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide Formula: C19H31ClN3O3S+ MolecularWeight: 416.98574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30ClN3O3S/c1-3-23(4-2)27(25,26)18-14-16(10-11-17(18)20)21-19(24)15-22-12-8-6-5-7-9-13-22/h10-11,14H,3-9,12-13,15H2,1-2H3,(H,21,24)/p+1