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methyl (1S,4R)-5-phenyl-5-pyridin-2-yl-bicyclo[2.1.1]hexane-6-carboxylate

methyl (1S,4R)-5-phenyl-5-pyridin-2-yl-bicyclo[2.1.1]hexane-6-carboxylate

Systemtic Name:methyl (1S,4R)-5-phenyl-5-pyridin-2-yl-bicyclo[2.1.1]hexane-6-carboxylate
Openeye Name:methyl (1S,4R)-5-phenyl-5-(2-pyridyl)bicyclo[2.1.1]hexane-6-carboxylate
CAS Name:(1S,4R)-5-phenyl-5-(2-pyridinyl)-6-bicyclo[2.1.1]hexanecarboxylic acid methyl ester
IUPAC Name:methyl (1S,4R)-5-phenyl-5-pyridin-2-ylbicyclo[2.1.1]hexane-6-carboxylate
Traditional Name:(1S,4R)-5-phenyl-5-(2-pyridyl)bicyclo[2.1.1]hexane-6-carboxylic acid methyl ester
Formula: C19H19NO2
MolecularWeight: 293.35966
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2CCC1C2(C3=CC=CC=C3)C4=CC=CC=N4


Isomeric SMILES

COC(=O)C1[C@H]2CC[C@@H]1C2(C3=CC=CC=C3)C4=CC=CC=N4


InChI

InChI=1S/C19H19NO2/c1-22-18(21)17-14-10-11-15(17)19(14,13-7-3-2-4-8-13)16-9-5-6-12-20-16/h2-9,12,14-15,17H,10-11H2,1H3/t14-,15+,17?,19?


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