tert-butyl (1S,4S)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

Systemtic Name: tert-butyl (1S,4S)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Openeye Name: tert-butyl (1S,4S)-5-(3-quinolyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate CAS Name: (1S,4S)-5-(3-quinolinyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,4S)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Traditional Name: (1S,4S)-5-(3-quinolyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester Formula: C19H23N3O2 MolecularWeight: 325.40482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2CC1CN2C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C19H23N3O2/c1-19(2,3)24-18(23)22-12-15-9-16(22)11-21(15)14-8-13-6-4-5-7-17(13)20-10-14/h4-8,10,15-16H,9,11-12H2,1-3H3/t15-,16-/m0/s1