(1R,5S)-5-(hydroxymethyl)-3-[2-(hydroxymethyl)-4-methyl-pentyl]-9-oxidanyl-1-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-7-one

Systemtic Name: (1R,5S)-5-(hydroxymethyl)-3-[2-(hydroxymethyl)-4-methyl-pentyl]-9-oxidanyl-1-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-7-one Openeye Name: (1R,5S)-1-benzyl-9-hydroxy-5-(hydroxymethyl)-3-[2-(hydroxymethyl)-4-methyl-pentyl]-3-azabicyclo[3.3.1]nonan-7-one CAS Name: (1R,5S)-9-hydroxy-5-(hydroxymethyl)-3-[2-(hydroxymethyl)-4-methylpentyl]-1-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-7-one IUPAC Name: (1R,5S)-1-benzyl-9-hydroxy-5-(hydroxymethyl)-3-[2-(hydroxymethyl)-4-methylpentyl]-3-azabicyclo[3.3.1]nonan-7-one Traditional Name: (1R,5S)-1-benzyl-9-hydroxy-3-(4-methyl-2-methylol-pentyl)-5-methylol-3-azabicyclo[3.3.1]nonan-7-one Formula: C23H35NO4 MolecularWeight: 389.5283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1CC2(CC(=O)CC(C1)(C2O)CO)CC3=CC=CC=C3)CO

Isomeric SMILES

CC(C)CC(CN1C[C@]2(CC(=O)C[C@@](C1)(C2O)CO)CC3=CC=CC=C3)CO

InChI

InChI=1S/C23H35NO4/c1-17(2)8-19(13-25)12-24-14-22(9-18-6-4-3-5-7-18)10-20(27)11-23(15-24,16-26)21(22)28/h3-7,17,19,21,25-26,28H,8-16H2,1-2H3/t19?,21?,22-,23+/m1/s1