(1R,3aR,8aS)-1-ethanoyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one

Systemtic Name: (1R,3aR,8aS)-1-ethanoyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one Openeye Name: (1R,3aR,8aS)-1-acetyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one CAS Name: (1R,3aR,8aS)-1-acetyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one IUPAC Name: (1R,3aR,8aS)-1-acetyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one Traditional Name: (1R,3aR,8aS)-1-acetyl-3a,6-dimethyl-1,2,3,4,6,7,8,8a-octahydroazulen-5-one Formula: C14H22O2 MolecularWeight: 222.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(CCC2(CC1=O)C)C(=O)C

Isomeric SMILES

CC1CC[C@H]2[C@@H](CC[C@@]2(CC1=O)C)C(=O)C

InChI

InChI=1S/C14H22O2/c1-9-4-5-12-11(10(2)15)6-7-14(12,3)8-13(9)16/h9,11-12H,4-8H2,1-3H3/t9?,11-,12-,14+/m0/s1