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

Systemtic Name: methyl (1S,3R,4R)-3-pyridin-3-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: methyl (1S,3R,4R)-3-(3-pyridyl)-7-azabicyclo[2.2.1]heptane-7-carboxylate CAS Name: (1S,3R,4R)-3-(3-pyridinyl)-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester IUPAC Name: methyl (1S,3R,4R)-3-pyridin-3-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Traditional Name: (1S,3R,4R)-3-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2/c1-17-13(16)15-10-4-5-12(15)11(7-10)9-3-2-6-14-8-9/h2-3,6,8,10-12H,4-5,7H2,1H3/t10-,11+,12+/m0/s1