2-(azocan-1-ium-1-yl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]acetamide Formula: C20H34N3O4S+ MolecularWeight: 412.56666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N3O4S/c1-4-23(5-2)28(25,26)17-11-12-19(27-3)18(15-17)21-20(24)16-22-13-9-7-6-8-10-14-22/h11-12,15H,4-10,13-14,16H2,1-3H3,(H,21,24)/p+1