(1R,3R)-1,3-dimethyl-9-oxidanyl-5-phenylmethoxy-3,4-dihydro-1H-benzo[g]isochromene-6,7-dione

Systemtic Name: (1R,3R)-1,3-dimethyl-9-oxidanyl-5-phenylmethoxy-3,4-dihydro-1H-benzo[g]isochromene-6,7-dione Openeye Name: (1R,3R)-5-benzyloxy-9-hydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-6,7-dione CAS Name: (1R,3R)-9-hydroxy-1,3-dimethyl-5-phenylmethoxy-3,4-dihydro-1H-benzo[g][2]benzopyran-6,7-dione IUPAC Name: (1R,3R)-9-hydroxy-1,3-dimethyl-5-phenylmethoxy-3,4-dihydro-1H-benzo[g]isochromene-6,7-dione Traditional Name: (1R,3R)-5-benzoxy-9-hydroxy-1,3-dimethyl-3,4-dihydro-1H-benz[g]isochromene-6,7-quinone Formula: C22H20O5 MolecularWeight: 364.3912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=C3C(=CC(=O)C(=O)C3=C2OCC4=CC=CC=C4)O)C(O1)C

Isomeric SMILES

C[C@@H]1CC2=C(C=C3C(=CC(=O)C(=O)C3=C2OCC4=CC=CC=C4)O)[C@H](O1)C

InChI

InChI=1S/C22H20O5/c1-12-8-16-15(13(2)27-12)9-17-18(23)10-19(24)21(25)20(17)22(16)26-11-14-6-4-3-5-7-14/h3-7,9-10,12-13,23H,8,11H2,1-2H3/t12-,13-/m1/s1