[(4S,5R)-5-methanoyl-2,4,6,6-tetramethyl-cyclohexen-1-yl]methyl ethanoate

Systemtic Name: [(4S,5R)-5-methanoyl-2,4,6,6-tetramethyl-cyclohexen-1-yl]methyl ethanoate Openeye Name: [(4S,5R)-5-formyl-2,4,6,6-tetramethyl-cyclohexen-1-yl]methyl acetate CAS Name: acetic acid [(4S,5R)-5-formyl-2,4,6,6-tetramethyl-1-cyclohexenyl]methyl ester IUPAC Name: [(4S,5R)-5-formyl-2,4,6,6-tetramethylcyclohexen-1-yl]methyl acetate Traditional Name: acetic acid [(4S,5R)-5-formyl-2,4,6,6-tetramethyl-cyclohexen-1-yl]methyl ester Formula: C14H22O3 MolecularWeight: 238.32268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=C(C(C1C=O)(C)C)COC(=O)C)C

Isomeric SMILES

C[C@H]1CC(=C(C([C@@H]1C=O)(C)C)COC(=O)C)C

InChI

InChI=1S/C14H22O3/c1-9-6-10(2)13(8-17-11(3)16)14(4,5)12(9)7-15/h7,9,12H,6,8H2,1-5H3/t9-,12+/m0/s1