[(2E,5E)-8-chloranyl-3,7-dimethyl-7-oxidanyl-octa-2,5-dienyl] ethanoate

Systemtic Name: [(2E,5E)-8-chloranyl-3,7-dimethyl-7-oxidanyl-octa-2,5-dienyl] ethanoate Openeye Name: [(2E,5E)-8-chloro-7-hydroxy-3,7-dimethyl-octa-2,5-dienyl] acetate CAS Name: acetic acid [(2E,5E)-8-chloro-7-hydroxy-3,7-dimethylocta-2,5-dienyl] ester IUPAC Name: [(2E,5E)-8-chloro-7-hydroxy-3,7-dimethylocta-2,5-dienyl] acetate Traditional Name: acetic acid [(2E,5E)-8-chloro-7-hydroxy-3,7-dimethyl-octa-2,5-dienyl] ester Formula: C12H19ClO3 MolecularWeight: 246.73046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C)CC=CC(C)(CCl)O

Isomeric SMILES

C/C(=C\COC(=O)C)/C/C=C/C(C)(CCl)O

InChI

InChI=1S/C12H19ClO3/c1-10(6-8-16-11(2)14)5-4-7-12(3,15)9-13/h4,6-7,15H,5,8-9H2,1-3H3/b7-4+,10-6+