[(1S,5R)-3,3,5-trimethyl-5-oxidanyl-4-(3-oxidanylidenebut-1-enylidene)cyclohexyl] ethanoate

Systemtic Name: [(1S,5R)-3,3,5-trimethyl-5-oxidanyl-4-(3-oxidanylidenebut-1-enylidene)cyclohexyl] ethanoate Openeye Name: [(1S,3R)-3-hydroxy-3,5,5-trimethyl-4-(3-oxobut-1-enylidene)cyclohexyl] acetate CAS Name: acetic acid [(1S,3R)-3-hydroxy-3,5,5-trimethyl-4-(3-oxobut-1-enylidene)cyclohexyl] ester IUPAC Name: [(1S,3R)-3-hydroxy-3,5,5-trimethyl-4-(3-oxobut-1-enylidene)cyclohexyl] acetate Traditional Name: acetic acid [(1S,3R)-3-hydroxy-4-(3-ketobut-1-enylidene)-3,5,5-trimethyl-cyclohexyl] ester Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=C=C1C(CC(CC1(C)O)OC(=O)C)(C)C

Isomeric SMILES

CC(=O)C=C=C1[C@](C[C@H](CC1(C)C)OC(=O)C)(C)O

InChI

InChI=1S/C15H22O4/c1-10(16)6-7-13-14(3,4)8-12(19-11(2)17)9-15(13,5)18/h6,12,18H,8-9H2,1-5H3/t7?,12-,15+/m0/s1