N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-3-(2-oxidanylidenepiperidin-1-yl)-N-phenethyl-propanamide

Systemtic Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-3-(2-oxidanylidenepiperidin-1-yl)-N-phenethyl-propanamide Openeye Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-3-(2-oxo-1-piperidyl)-N-phenethyl-propanamide CAS Name: N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-3-(2-oxo-1-piperidinyl)-N-phenethylpropanamide IUPAC Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-3-(2-oxopiperidin-1-yl)-N-phenethylpropanamide Traditional Name: 3-(2-ketopiperidino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-propionamide Formula: C23H36N3O2+ MolecularWeight: 386.55084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(CCC2=CC=CC=C2)C(=O)CCN3CCCCC3=O

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CN(CCC2=CC=CC=C2)C(=O)CCN3CCCCC3=O

InChI

InChI=1S/C23H35N3O2/c1-24-14-7-10-21(18-24)19-26(16-12-20-8-3-2-4-9-20)23(28)13-17-25-15-6-5-11-22(25)27/h2-4,8-9,21H,5-7,10-19H2,1H3/p+1/t21-/m0/s1