[3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone

Systemtic Name: [3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone Openeye Name: [3-benzyl-3-(hydroxymethyl)-1-piperidyl]-(1H-pyrazol-4-yl)methanone CAS Name: [3-(hydroxymethyl)-3-(phenylmethyl)-1-piperidinyl]-(1H-pyrazol-4-yl)methanone IUPAC Name: [3-benzyl-3-(hydroxymethyl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone Traditional Name: (3-benzyl-3-methylol-piperidino)-(1H-pyrazol-4-yl)methanone Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CNN=C2)(CC3=CC=CC=C3)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CNN=C2)(CC3=CC=CC=C3)CO

InChI

InChI=1S/C17H21N3O2/c21-13-17(9-14-5-2-1-3-6-14)7-4-8-20(12-17)16(22)15-10-18-19-11-15/h1-3,5-6,10-11,21H,4,7-9,12-13H2,(H,18,19)