1-[(3S)-3-[[4-(morpholin-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-[(3S)-3-[[4-(morpholin-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]-2-pyrazol-1-yl-ethanone Openeye Name: 1-[(3S)-3-[[4-(morpholinomethyl)phenoxy]methyl]-1-piperidyl]-2-pyrazol-1-yl-ethanone CAS Name: 1-[(3S)-3-[[4-(4-morpholinylmethyl)phenoxy]methyl]-1-piperidinyl]-2-(1-pyrazolyl)ethanone IUPAC Name: 1-[(3S)-3-[[4-(morpholin-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]-2-pyrazol-1-ylethanone Traditional Name: 1-[(3S)-3-[[4-(morpholinomethyl)phenoxy]methyl]piperidino]-2-pyrazol-1-yl-ethanone Formula: C22H30N4O3 MolecularWeight: 398.4986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C=CC=N2)COC3=CC=C(C=C3)CN4CCOCC4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CN2C=CC=N2)COC3=CC=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C22H30N4O3/c27-22(17-26-10-2-8-23-26)25-9-1-3-20(16-25)18-29-21-6-4-19(5-7-21)15-24-11-13-28-14-12-24/h2,4-8,10,20H,1,3,9,11-18H2/t20-/m0/s1