(E)-3-(furan-2-yl)-1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(furan-2-yl)-1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2-furyl)-1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(2-furanyl)-1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(furan-2-yl)-1-[(3R)-3-(hydroxymethyl)-3-phenethylpiperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2-furyl)-1-[(3R)-3-methylol-3-phenethyl-piperidino]prop-2-en-1-one Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC=CO2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@](CN(C1)C(=O)/C=C/C2=CC=CO2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C21H25NO3/c23-17-21(13-11-18-6-2-1-3-7-18)12-5-14-22(16-21)20(24)10-9-19-8-4-15-25-19/h1-4,6-10,15,23H,5,11-14,16-17H2/b10-9+/t21-/m0/s1