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

Systemtic Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide CAS Name: N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-N-phenethyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide IUPAC Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionamide Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(CCC2=CC=CC=C2)C(=O)CCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CN(CCC2=CC=CC=C2)C(=O)CCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2/c1-29-17-8-11-22(19-29)20-30(18-16-21-9-4-2-5-10-21)25(31)15-14-24-27-26(28-32-24)23-12-6-3-7-13-23/h2-7,9-10,12-13,22H,8,11,14-20H2,1H3/p+1/t22-/m0/s1