(4-oxidanyl-4-pyridin-2-yl-piperidin-1-yl)-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone

Systemtic Name: (4-oxidanyl-4-pyridin-2-yl-piperidin-1-yl)-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone Openeye Name: [4-hydroxy-4-(2-pyridyl)-1-piperidyl]-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone CAS Name: [4-hydroxy-4-(2-pyridinyl)-1-piperidinyl]-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone IUPAC Name: (4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone Traditional Name: [4-hydroxy-4-(2-pyridyl)piperidino]-[5-(phenoxymethyl)-1H-pyrazol-3-yl]methanone Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=N2)O)C(=O)C3=NNC(=C3)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=N2)O)C(=O)C3=NNC(=C3)COC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3/c26-20(18-14-16(23-24-18)15-28-17-6-2-1-3-7-17)25-12-9-21(27,10-13-25)19-8-4-5-11-22-19/h1-8,11,14,27H,9-10,12-13,15H2,(H,23,24)