[(2E,4S)-3,7-dimethyl-1-oxidanylidene-octa-2,6-dien-4-yl] ethanoate

Systemtic Name: [(2E,4S)-3,7-dimethyl-1-oxidanylidene-octa-2,6-dien-4-yl] ethanoate Openeye Name: [(1S)-4-methyl-1-[(E)-1-methyl-3-oxo-prop-1-enyl]pent-3-enyl] acetate CAS Name: acetic acid [(2E,4S)-3,7-dimethyl-1-oxoocta-2,6-dien-4-yl] ester IUPAC Name: [(2E,4S)-3,7-dimethyl-1-oxoocta-2,6-dien-4-yl] acetate Traditional Name: acetic acid [(1S)-1-[(E)-3-keto-1-methyl-prop-1-enyl]-4-methyl-pent-3-enyl] ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O3/c1-9(2)5-6-12(15-11(4)14)10(3)7-8-13/h5,7-8,12H,6H2,1-4H3/b10-7+/t12-/m0/s1