(3R,4R)-4-morpholin-4-yl-1-[[2-(2-phenylethynyl)phenyl]methyl]piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-4-morpholin-4-yl-1-[[2-(2-phenylethynyl)phenyl]methyl]piperidin-1-ium-3-ol Openeye Name: (3R,4R)-4-morpholino-1-[[2-(2-phenylethynyl)phenyl]methyl]piperidin-1-ium-3-ol CAS Name: (3R,4R)-4-(4-morpholinyl)-1-[[2-(2-phenylethynyl)phenyl]methyl]-3-piperidin-1-iumol IUPAC Name: (3R,4R)-4-morpholin-4-yl-1-[[2-(2-phenylethynyl)phenyl]methyl]piperidin-1-ium-3-ol Traditional Name: (3R,4R)-4-morpholino-1-[2-(2-phenylethynyl)benzyl]piperidin-1-ium-3-ol Formula: C24H29N2O2+ MolecularWeight: 377.49926

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(C1N2CCOCC2)O)CC3=CC=CC=C3C#CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]([C@@H]1N2CCOCC2)O)CC3=CC=CC=C3C#CC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O2/c27-24-19-25(13-12-23(24)26-14-16-28-17-15-26)18-22-9-5-4-8-21(22)11-10-20-6-2-1-3-7-20/h1-9,23-24,27H,12-19H2/p+1/t23-,24-/m1/s1