(1R)-1-phenyl-5-piperidin-1-ium-1-yl-1-pyridin-4-yl-pent-3-yn-1-ol

Systemtic Name: (1R)-1-phenyl-5-piperidin-1-ium-1-yl-1-pyridin-4-yl-pent-3-yn-1-ol Openeye Name: (1R)-1-phenyl-5-piperidin-1-ium-1-yl-1-(4-pyridyl)pent-3-yn-1-ol CAS Name: (1R)-1-phenyl-5-(1-piperidin-1-iumyl)-1-pyridin-4-yl-3-pentyn-1-ol IUPAC Name: (1R)-1-phenyl-5-piperidin-1-ium-1-yl-1-pyridin-4-ylpent-3-yn-1-ol Traditional Name: (1R)-1-phenyl-5-piperidin-1-ium-1-yl-1-(4-pyridyl)pent-3-yn-1-ol Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC#CCC(C2=CC=CC=C2)(C3=CC=NC=C3)O

Isomeric SMILES

C1CC[NH+](CC1)CC#CC[C@@](C2=CC=CC=C2)(C3=CC=NC=C3)O

InChI

InChI=1S/C21H24N2O/c24-21(19-9-3-1-4-10-19,20-11-14-22-15-12-20)13-5-8-18-23-16-6-2-7-17-23/h1,3-4,9-12,14-15,24H,2,6-7,13,16-18H2/p+1/t21-/m1/s1