(3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N,N-diethyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC[NH+](C1)CC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCC[NH+](C1)CC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4O2/c1-3-23(4-2)19(24)16-11-8-12-22(13-16)14-17-20-18(21-25-17)15-9-6-5-7-10-15/h5-7,9-10,16H,3-4,8,11-14H2,1-2H3/p+1/t16-/m0/s1