(phenylmethyl) (1S,5S)-6-pyridin-3-yl-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate

Systemtic Name: (phenylmethyl) (1S,5S)-6-pyridin-3-yl-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate Openeye Name: benzyl (1S,5S)-6-(3-pyridyl)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate CAS Name: (1S,5S)-6-(3-pyridinyl)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,5S)-6-pyridin-3-yl-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate Traditional Name: (1S,5S)-6-(3-pyridyl)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylic acid benzyl ester Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C2CN1C(=O)OCC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1[C@@H]2CN([C@@H]2CN1C(=O)OCC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C18H19N3O2/c22-18(23-13-14-5-2-1-3-6-14)20-10-15-11-21(17(15)12-20)16-7-4-8-19-9-16/h1-9,15,17H,10-13H2/t15-,17-/m1/s1