(3S,7aR)-3-pyridin-2-yl-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one

Systemtic Name: (3S,7aR)-3-pyridin-2-yl-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one Openeye Name: (3S,7aR)-3-(2-pyridyl)-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one CAS Name: (3S,7aR)-3-(2-pyridinyl)-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one IUPAC Name: (3S,7aR)-3-pyridin-2-yl-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one Traditional Name: (3S,7aR)-3-(2-pyridyl)-3,4,7,7a-tetrahydro-1H-cyclopenta[c]pyran-6-one Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

C1C2COC(CC2=CC1=O)C3=CC=CC=N3

Isomeric SMILES

C1[C@H]2CO[C@@H](CC2=CC1=O)C3=CC=CC=N3

InChI

InChI=1S/C13H13NO2/c15-11-5-9-7-13(16-8-10(9)6-11)12-3-1-2-4-14-12/h1-5,10,13H,6-8H2/t10-,13-/m0/s1