(1R,7S)-4,4-dimethyl-8-phenyl-bicyclo[5.1.0]octane-2,6-dione

Systemtic Name: (1R,7S)-4,4-dimethyl-8-phenyl-bicyclo[5.1.0]octane-2,6-dione Openeye Name: (1R,7S)-4,4-dimethyl-8-phenyl-bicyclo[5.1.0]octane-2,6-dione CAS Name: (1R,7S)-4,4-dimethyl-8-phenylbicyclo[5.1.0]octane-2,6-dione IUPAC Name: (1R,7S)-4,4-dimethyl-8-phenylbicyclo[5.1.0]octane-2,6-dione Traditional Name: (1R,7S)-4,4-dimethyl-8-phenyl-bicyclo[5.1.0]octane-2,6-quinone Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2C(C2C3=CC=CC=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)[C@@H]2[C@@H](C2C3=CC=CC=C3)C(=O)C1)C

InChI

InChI=1S/C16H18O2/c1-16(2)8-11(17)14-13(15(14)12(18)9-16)10-6-4-3-5-7-10/h3-7,13-15H,8-9H2,1-2H3/t13?,14-,15+