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

Systemtic Name: [(2R)-2-[(1S,2S,5S)-5-methyl-2-oxidanyl-cyclohept-3-en-1-yl]propyl] ethanoate Openeye Name: [(2R)-2-[(1S,2S,5S)-2-hydroxy-5-methyl-cyclohept-3-en-1-yl]propyl] acetate CAS Name: acetic acid [(2R)-2-[(1S,2S,5S)-2-hydroxy-5-methyl-1-cyclohept-3-enyl]propyl] ester IUPAC Name: [(2R)-2-[(1S,2S,5S)-2-hydroxy-5-methylcyclohept-3-en-1-yl]propyl] acetate Traditional Name: acetic acid [(2R)-2-[(1S,2S,5S)-2-hydroxy-5-methyl-cyclohept-3-en-1-yl]propyl] ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22O3/c1-9-4-6-12(13(15)7-5-9)10(2)8-16-11(3)14/h5,7,9-10,12-13,15H,4,6,8H2,1-3H3/t9-,10-,12-,13-/m0/s1