[(3S,4S)-3-oxidanyl-1-(6-oxidanylidenecyclohexen-1-yl)decan-4-yl] ethanoate

Systemtic Name: [(3S,4S)-3-oxidanyl-1-(6-oxidanylidenecyclohexen-1-yl)decan-4-yl] ethanoate Openeye Name: [(1S)-1-[(1S)-1-hydroxy-3-(6-oxocyclohexen-1-yl)propyl]heptyl] acetate CAS Name: acetic acid [(3S,4S)-3-hydroxy-1-(6-oxo-1-cyclohexenyl)decan-4-yl] ester IUPAC Name: [(3S,4S)-3-hydroxy-1-(6-oxocyclohexen-1-yl)decan-4-yl] acetate Traditional Name: acetic acid [(1S)-1-[(1S)-1-hydroxy-3-(6-ketocyclohexen-1-yl)propyl]heptyl] ester Formula: C18H30O4 MolecularWeight: 310.4284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CCC1=CCCCC1=O)O)OC(=O)C

Isomeric SMILES

CCCCCC[C@@H]([C@H](CCC1=CCCCC1=O)O)OC(=O)C

InChI

InChI=1S/C18H30O4/c1-3-4-5-6-11-18(22-14(2)19)17(21)13-12-15-9-7-8-10-16(15)20/h9,17-18,21H,3-8,10-13H2,1-2H3/t17-,18-/m0/s1