[(2R,3E,5E)-7-oxidanylidenehepta-3,5-dien-2-yl] ethanoate

Systemtic Name: [(2R,3E,5E)-7-oxidanylidenehepta-3,5-dien-2-yl] ethanoate Openeye Name: [(1R,2E,4E)-1-methyl-6-oxo-hexa-2,4-dienyl] acetate CAS Name: acetic acid [(2R,3E,5E)-7-oxohepta-3,5-dien-2-yl] ester IUPAC Name: [(2R,3E,5E)-7-oxohepta-3,5-dien-2-yl] acetate Traditional Name: acetic acid [(1R,2E,4E)-6-keto-1-methyl-hexa-2,4-dienyl] ester Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC=CC=O)OC(=O)C

Isomeric SMILES

C[C@H](/C=C/C=C/C=O)OC(=O)C

InChI

InChI=1S/C9H12O3/c1-8(12-9(2)11)6-4-3-5-7-10/h3-8H,1-2H3/b5-3+,6-4+/t8-/m1/s1