3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propanamide CAS Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(2-pyridinylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Traditional Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propionamide Formula: C22H26N5O2+ MolecularWeight: 392.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=N2)NC(=O)CCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=N2)NC(=O)CCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2/c28-20(11-12-21-25-22(26-29-21)17-7-2-1-3-8-17)24-19-10-6-14-27(16-19)15-18-9-4-5-13-23-18/h1-5,7-9,13,19H,6,10-12,14-16H2,(H,24,28)/p+1/t19-/m0/s1