[(3R,4S)-4-propylpiperidin-3-yl] benzoate

Systemtic Name: [(3R,4S)-4-propylpiperidin-3-yl] benzoate Openeye Name: [(3R,4S)-4-propyl-3-piperidyl] benzoate CAS Name: benzoic acid [(3R,4S)-4-propyl-3-piperidinyl] ester IUPAC Name: [(3R,4S)-4-propylpiperidin-3-yl] benzoate Traditional Name: benzoic acid [(3R,4S)-4-propyl-3-piperidyl] ester Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCNCC1OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC[C@H]1CCNC[C@@H]1OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c1-2-6-12-9-10-16-11-14(12)18-15(17)13-7-4-3-5-8-13/h3-5,7-8,12,14,16H,2,6,9-11H2,1H3/t12-,14-/m0/s1