1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-2-pyrazol-1-yl-ethanone Openeye Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidyl]-2-pyrazol-1-yl-ethanone CAS Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidinyl]-2-(1-pyrazolyl)ethanone IUPAC Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethylpiperidin-1-yl]-2-pyrazol-1-ylethanone Traditional Name: 1-[(3R)-3-methylol-3-phenethyl-piperidino]-2-pyrazol-1-yl-ethanone Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C=CC=N2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@](CN(C1)C(=O)CN2C=CC=N2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C19H25N3O2/c23-16-19(10-8-17-6-2-1-3-7-17)9-4-12-21(15-19)18(24)14-22-13-5-11-20-22/h1-3,5-7,11,13,23H,4,8-10,12,14-16H2/t19-/m0/s1