(1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-dione

Systemtic Name: (1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-dione Openeye Name: (1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-dione CAS Name: (1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-dione IUPAC Name: (1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-dione Traditional Name: (1S,4S,5S)-4-phenylbicyclo[3.3.1]non-7-ene-2,6-quinone Formula: C15H14O2 MolecularWeight: 226.27046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC(=O)C1C(CC2=O)C3=CC=CC=C3

Isomeric SMILES

C1[C@H]2C=CC(=O)[C@@H]1[C@H](CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C15H14O2/c16-14-7-6-11-8-13(14)12(9-15(11)17)10-4-2-1-3-5-10/h1-7,11-13H,8-9H2/t11-,12-,13+/m1/s1