(3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl]piperidin-1-ium-3-carboxamide Formula: C16H26N3O4S+ MolecularWeight: 356.46034

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)OCC[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)OCC[NH+]2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C16H25N3O4S/c1-18(2)24(21,22)15-7-5-14(6-8-15)23-11-10-19-9-3-4-13(12-19)16(17)20/h5-8,13H,3-4,9-12H2,1-2H3,(H2,17,20)/p+1/t13-/m0/s1