[(2S)-2-[(1S,5S)-5-methyl-2-oxidanylidene-cyclohept-3-en-1-yl]propyl] ethanoate

Systemtic Name: [(2S)-2-[(1S,5S)-5-methyl-2-oxidanylidene-cyclohept-3-en-1-yl]propyl] ethanoate Openeye Name: [(2S)-2-[(1S,5S)-5-methyl-2-oxo-cyclohept-3-en-1-yl]propyl] acetate CAS Name: acetic acid [(2S)-2-[(1S,5S)-5-methyl-2-oxo-1-cyclohept-3-enyl]propyl] ester IUPAC Name: [(2S)-2-[(1S,5S)-5-methyl-2-oxocyclohept-3-en-1-yl]propyl] acetate Traditional Name: acetic acid [(2S)-2-[(1S,5S)-2-keto-5-methyl-cyclohept-3-en-1-yl]propyl] ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C=C1)C(C)COC(=O)C

Isomeric SMILES

C[C@H]1CC[C@H](C(=O)C=C1)[C@H](C)COC(=O)C

InChI

InChI=1S/C13H20O3/c1-9-4-6-12(13(15)7-5-9)10(2)8-16-11(3)14/h5,7,9-10,12H,4,6,8H2,1-3H3/t9-,10+,12-/m0/s1