(1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one

Systemtic Name: (1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one Openeye Name: (1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one CAS Name: (1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one IUPAC Name: (1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one Traditional Name: (1R,4S,5R)-5-(2-nitrophenyl)-3-oxabicyclo[2.2.2]octan-2-one Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1C(=O)O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1C[C@H]2[C@H](C[C@@H]1C(=O)O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C13H13NO4/c15-13-8-5-6-12(18-13)10(7-8)9-3-1-2-4-11(9)14(16)17/h1-4,8,10,12H,5-7H2/t8-,10-,12+/m1/s1