methyl (1S,3S,4R)-3-pyridin-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate

Systemtic Name: methyl (1S,3S,4R)-3-pyridin-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: methyl (1S,3S,4R)-3-(2-pyridyl)-7-azabicyclo[2.2.1]heptane-7-carboxylate CAS Name: (1S,3S,4R)-3-(2-pyridinyl)-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester IUPAC Name: methyl (1S,3S,4R)-3-pyridin-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Traditional Name: (1S,3S,4R)-3-(2-pyridyl)-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2CCC1C(C2)C3=CC=CC=N3

Isomeric SMILES

COC(=O)N1[C@H]2CC[C@@H]1[C@H](C2)C3=CC=CC=N3

InChI

InChI=1S/C13H16N2O2/c1-17-13(16)15-9-5-6-12(15)10(8-9)11-4-2-3-7-14-11/h2-4,7,9-10,12H,5-6,8H2,1H3/t9-,10+,12+/m0/s1