(3R,3aR,8aR)-6,8a-dimethyl-3-oxidanyl-3-propan-2-yl-1,2,3a,8-tetrahydroazulene-4,7-dione

Systemtic Name: (3R,3aR,8aR)-6,8a-dimethyl-3-oxidanyl-3-propan-2-yl-1,2,3a,8-tetrahydroazulene-4,7-dione Openeye Name: (3R,3aR,8aR)-3-hydroxy-3-isopropyl-6,8a-dimethyl-1,2,3a,8-tetrahydroazulene-4,7-dione CAS Name: (3R,3aR,8aR)-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,8-tetrahydroazulene-4,7-dione IUPAC Name: (3R,3aR,8aR)-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,8-tetrahydroazulene-4,7-dione Traditional Name: (3R,3aR,8aR)-3-hydroxy-3-isopropyl-6,8a-dimethyl-1,2,3a,8-tetrahydroazulene-4,7-quinone Formula: C15H22O3 MolecularWeight: 250.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2C(CCC2(C(C)C)O)(CC1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-9(2)15(18)6-5-14(4)8-12(17)10(3)7-11(16)13(14)15/h7,9,13,18H,5-6,8H2,1-4H3/t13-,14-,15-/m1/s1