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

Systemtic Name: (1R)-1-phenyl-1-pyridin-4-yl-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol Openeye Name: (1R)-1-phenyl-1-(4-pyridyl)-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol CAS Name: (1R)-1-phenyl-1-pyridin-4-yl-5-(1-pyrrolidin-1-iumyl)-3-pentyn-1-ol IUPAC Name: (1R)-1-phenyl-1-pyridin-4-yl-5-pyrrolidin-1-ium-1-ylpent-3-yn-1-ol Traditional Name: (1R)-1-phenyl-1-(4-pyridyl)-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol Formula: C20H23N2O+ MolecularWeight: 307.40942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC#CCC(C2=CC=CC=C2)(C3=CC=NC=C3)O

Isomeric SMILES

C1CC[NH+](C1)CC#CC[C@@](C2=CC=CC=C2)(C3=CC=NC=C3)O

InChI

InChI=1S/C20H22N2O/c23-20(18-8-2-1-3-9-18,19-10-13-21-14-11-19)12-4-5-15-22-16-6-7-17-22/h1-3,8-11,13-14,23H,6-7,12,15-17H2/p+1/t20-/m1/s1