2-(4-oxidanylpiperidin-1-ium-1-yl)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(4-oxidanylpiperidin-1-ium-1-yl)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]ethanamide Openeye Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]acetamide CAS Name: 2-(4-hydroxy-1-piperidin-1-iumyl)-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]acetamide IUPAC Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]acetamide Traditional Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]acetamide Formula: C20H33N3O2+2 MolecularWeight: 347.49492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCC2=CC=CC=C2)NC(=O)C[NH+]3CCC(CC3)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCC2=CC=CC=C2)NC(=O)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C20H31N3O2/c24-19-9-13-23(14-10-19)16-20(25)21-18-7-4-11-22(15-18)12-8-17-5-2-1-3-6-17/h1-3,5-6,18-19,24H,4,7-16H2,(H,21,25)/p+2/t18-/m0/s1