methyl (1S,4R)-3-(6-chloranylpyridin-3-yl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate

Systemtic Name: methyl (1S,4R)-3-(6-chloranylpyridin-3-yl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate Openeye Name: methyl (1S,4R)-3-(6-chloro-3-pyridyl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate CAS Name: (1S,4R)-3-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylic acid methyl ester IUPAC Name: methyl (1S,4R)-3-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate Traditional Name: (1S,4R)-3-(6-chloro-3-pyridyl)-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylic acid methyl ester Formula: C13H13ClN2O2 MolecularWeight: 264.70752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2CCC1C(=C2)C3=CN=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2O2/c1-18-13(17)16-9-3-4-11(16)10(6-9)8-2-5-12(14)15-7-8/h2,5-7,9,11H,3-4H2,1H3/t9-,11+/m0/s1