2-[(3R,4S)-3-ethyl-1-(phenylcarbonyl)piperidin-4-yl]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[(3R,4S)-3-ethyl-1-(phenylcarbonyl)piperidin-4-yl]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-[(3R,4S)-1-benzoyl-3-ethyl-4-piperidyl]-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-[(3R,4S)-1-benzoyl-3-ethyl-4-piperidinyl]-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-[(3R,4S)-1-benzoyl-3-ethylpiperidin-4-yl]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-[(3R,4S)-1-benzoyl-3-ethyl-4-piperidyl]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C22H34N3O3+ MolecularWeight: 388.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC1CC(=O)NCC[NH+]2CCOCC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC[C@H]1CN(CC[C@H]1CC(=O)NCC[NH+]2CCOCC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H33N3O3/c1-2-18-17-25(22(27)19-6-4-3-5-7-19)10-8-20(18)16-21(26)23-9-11-24-12-14-28-15-13-24/h3-7,18,20H,2,8-17H2,1H3,(H,23,26)/p+1/t18-,20-/m0/s1