N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H30N3O4S+ MolecularWeight: 384.5135

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C[NH+]2CCCC2)OCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C[NH+]2CCCC2)OCC

InChI

InChI=1S/C18H29N3O4S/c1-4-21(5-2)26(23,24)17-13-15(9-10-16(17)25-6-3)19-18(22)14-20-11-7-8-12-20/h9-10,13H,4-8,11-12,14H2,1-3H3,(H,19,22)/p+1