3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethylpiperidin-1-ium-3-yl]methyl]propanamide

Systemtic Name: 3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethylpiperidin-1-ium-3-yl]methyl]propanamide Openeye Name: 3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethylpiperidin-1-ium-3-yl]methyl]propanamide CAS Name: 3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethyl-3-piperidin-1-iumyl]methyl]propanamide IUPAC Name: 3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethylpiperidin-1-ium-3-yl]methyl]propanamide Traditional Name: 3-(5-phenethyl-1,3,4-oxadiazol-2-yl)-N-[[(3R)-1-phenethylpiperidin-1-ium-3-yl]methyl]propionamide Formula: C27H35N4O2+ MolecularWeight: 447.5924

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCC2=CC=CC=C2)CNC(=O)CCC3=NN=C(O3)CCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCC2=CC=CC=C2)CNC(=O)CCC3=NN=C(O3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O2/c32-25(14-16-27-30-29-26(33-27)15-13-22-8-3-1-4-9-22)28-20-24-12-7-18-31(21-24)19-17-23-10-5-2-6-11-23/h1-6,8-11,24H,7,12-21H2,(H,28,32)/p+1/t24-/m1/s1