1-[(3R,4S)-3-ethylpiperidin-4-yl]-3-(2-methoxyquinolin-4-yl)propan-2-one

Systemtic Name: 1-[(3R,4S)-3-ethylpiperidin-4-yl]-3-(2-methoxyquinolin-4-yl)propan-2-one Openeye Name: 1-[(3R,4S)-3-ethyl-4-piperidyl]-3-(2-methoxy-4-quinolyl)propan-2-one CAS Name: 1-[(3R,4S)-3-ethyl-4-piperidinyl]-3-(2-methoxy-4-quinolinyl)-2-propanone IUPAC Name: 1-[(3R,4S)-3-ethylpiperidin-4-yl]-3-(2-methoxyquinolin-4-yl)propan-2-one Traditional Name: 1-[(3R,4S)-3-ethyl-4-piperidyl]-3-(2-methoxy-4-quinolyl)acetone Formula: C20H26N2O2 MolecularWeight: 326.43264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CNCCC1CC(=O)CC2=CC(=NC3=CC=CC=C32)OC

Isomeric SMILES

CC[C@H]1CNCC[C@H]1CC(=O)CC2=CC(=NC3=CC=CC=C32)OC

InChI

InChI=1S/C20H26N2O2/c1-3-14-13-21-9-8-15(14)10-17(23)11-16-12-20(24-2)22-19-7-5-4-6-18(16)19/h4-7,12,14-15,21H,3,8-11,13H2,1-2H3/t14-,15-/m0/s1