tert-butyl (1'S,4'R,5R)-3-pyridin-4-ylspiro[4H-1,2-oxazole-5,3'-7-azabicyclo[2.2.1]heptane]-7'-carboxylate

Systemtic Name: tert-butyl (1'S,4'R,5R)-3-pyridin-4-ylspiro[4H-1,2-oxazole-5,3'-7-azabicyclo[2.2.1]heptane]-7'-carboxylate Openeye Name: tert-butyl (1'S,4'R,5R)-3-(4-pyridyl)spiro[4H-isoxazole-5,3'-7-azabicyclo[2.2.1]heptane]-7'-carboxylate CAS Name: (1'S,4'R,5R)-3-pyridin-4-yl-7'-spiro[4H-isoxazole-5,3'-7-azabicyclo[2.2.1]heptane]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1'S,4'R,5R)-3-pyridin-4-ylspiro[4H-1,2-oxazole-5,3'-7-azabicyclo[2.2.1]heptane]-7'-carboxylate Traditional Name: (1'S,4'R,5R)-3-(4-pyridyl)spiro[2-isoxazoline-5,3'-7-azabicyclo[2.2.1]heptane]-7'-carboxylic acid tert-butyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCC1C3(C2)CC(=NO3)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@]3(C2)CC(=NO3)C4=CC=NC=C4

InChI

InChI=1S/C18H23N3O3/c1-17(2,3)23-16(22)21-13-4-5-15(21)18(10-13)11-14(20-24-18)12-6-8-19-9-7-12/h6-9,13,15H,4-5,10-11H2,1-3H3/t13-,15+,18+/m0/s1