(3S)-1-[2-[[2-(dimethylamino)phenyl]carbonylamino]ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[2-[[2-(dimethylamino)phenyl]carbonylamino]ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[2-[[2-(dimethylamino)benzoyl]amino]ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[2-[[[2-(dimethylamino)phenyl]-oxomethyl]amino]ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[2-[[2-(dimethylamino)benzoyl]amino]ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[2-[[2-(dimethylamino)benzoyl]amino]ethyl]piperidin-1-ium-3-carboxamide Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1C(=O)NCC[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

CN(C)C1=CC=CC=C1C(=O)NCC[NH+]2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C17H26N4O2/c1-20(2)15-8-4-3-7-14(15)17(23)19-9-11-21-10-5-6-13(12-21)16(18)22/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H2,18,22)(H,19,23)/p+1/t13-/m0/s1