ethyl (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate

Systemtic Name: ethyl (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Openeye Name: ethyl (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate CAS Name: (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Traditional Name: (1R,5S)-3-[2-(2-fluorophenyl)ethynyl]-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid ethyl ester Formula: C18H18FNO2 MolecularWeight: 299.339423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC1C=C(C2)C#CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)N1[C@@H]2CC[C@H]1C=C(C2)C#CC3=CC=CC=C3F

InChI

InChI=1S/C18H18FNO2/c1-2-22-18(21)20-15-9-10-16(20)12-13(11-15)7-8-14-5-3-4-6-17(14)19/h3-6,11,15-16H,2,9-10,12H2,1H3/t15-,16+/m0/s1