1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-3-pyrazin-2-yl-propan-1-one

Systemtic Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-3-pyrazin-2-yl-propan-1-one Openeye Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidyl]-3-pyrazin-2-yl-propan-1-one CAS Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidinyl]-3-(2-pyrazinyl)-1-propanone IUPAC Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethylpiperidin-1-yl]-3-pyrazin-2-ylpropan-1-one Traditional Name: 1-[(3R)-3-methylol-3-phenethyl-piperidino]-3-pyrazin-2-yl-propan-1-one Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=NC=CN=C2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@](CN(C1)C(=O)CCC2=NC=CN=C2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C21H27N3O2/c25-17-21(11-9-18-5-2-1-3-6-18)10-4-14-24(16-21)20(26)8-7-19-15-22-12-13-23-19/h1-3,5-6,12-13,15,25H,4,7-11,14,16-17H2/t21-/m0/s1